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ethyl 2-(anilinocarbamothioylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

ethyl 2-(anilinocarbamothioylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate structure

CAS No:
380342-80-3
Formula:
C18H21N3O2S2
Chemical Name:
ethyl 2-(anilinocarbamothioylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Synonyms:
ZINC3251939;STL454121;AKOS034457976;MCULE-1766065918;Z56821612;380342-80-3;ethyl 2-{[(2-phenylhydrazinyl)carbonothioyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate;ethyl 2-{[(phenylamino)carbamothioyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

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ethyl 2-(anilinocarbamothioylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Basic Attributes

Molecular Weight：

375.5 g/mol

Exact Mass：

375.10751927 g/mol

Characteristics

PSA：

123 Å²

Computed Properties

Molecular Weight:375.5
XLogP3:5.4
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:375.10751927
Monoisotopic Mass:375.10751927
Topological Polar Surface Area:123
Heavy Atom Count:25
Complexity:471
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl 2-(anilinocarbamothioylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Basic Attributes
Characteristics
Computed Properties
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