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N-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)carbamothioyl]-3,4,5-trimethoxybenzamide
N-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)carbamothioyl]-3,4,5-trimethoxybenzamide
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![N-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)carbamothioyl]-3,4,5-trimethoxybenzamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/e322c46b7db34fb4932ff8302d507093.png "N-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)carbamothioyl]-3,4,5-trimethoxybenzamide")
N-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)carbamothioyl]-3,4,5-trimethoxybenzamide
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CAS No:
477496-91-6
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Formula:
C21H23N3O4S2
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Chemical Name:
N-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)carbamothioyl]-3,4,5-trimethoxybenzamide
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Synonyms:
Oprea1_497987;ZINC2225154;STK545092;AKOS005473738;MCULE-6022682803;N-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)carbamothioyl]-3,4,5-trimethoxybenzamide;477496-91-6
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CAS No:
N-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)carbamothioyl]-3,4,5-trimethoxybenzamide Basic Attributes
445.6 g/mol
445.11299857 g/mol
Computed Properties
Molecular Weight:445.6
XLogP3:4.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:445.11299857
Monoisotopic Mass:445.11299857
Topological Polar Surface Area:153
Heavy Atom Count:30
Complexity:656
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of N-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)carbamothioyl]-3,4,5-trimethoxybenzamide
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