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methyl 2-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]benzoate

methyl 2-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]benzoate structure

CAS No:
791792-29-5
Formula:
C16H14N2O3S2
Chemical Name:
methyl 2-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]benzoate
Synonyms:
791792-29-5;(E)-methyl 2-(3-(3-(thiophen-2-yl)acryloyl)thioureido)benzoate;METHYL 2-({[(2E)-3-(THIOPHEN-2-YL)PROP-2-ENAMIDO]METHANETHIOYL}AMINO)BENZOATE;ARONIS008383;ZINC1003848;STK324173;AKOS000497701;methyl 2-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]benzoate;AN-329/42607843;F1724-0807;methyl 2-[({[3-(2-thienyl)acryloyl]amino}carbothioyl)amino]benzoate;methyl 2-({[(2E)-3-(thiophen-2-yl)prop-2-enoyl]carbamothioyl}amino)benzoate

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methyl 2-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]benzoate Basic Attributes

Molecular Weight：

346.4 g/mol

Exact Mass：

346.04458466 g/mol

Characteristics

PSA：

128 Å²

Computed Properties

Molecular Weight:346.4
XLogP3:3.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:346.04458466
Monoisotopic Mass:346.04458466
Topological Polar Surface Area:128
Heavy Atom Count:23
Complexity:482
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of methyl 2-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]benzoate

Basic Attributes
Characteristics
Computed Properties
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