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N-[2-cyanoethyl-[(4-ethoxyphenyl)methyl]carbamothioyl]benzamide

N-[2-cyanoethyl-[(4-ethoxyphenyl)methyl]carbamothioyl]benzamide

Systemtic Name:N-[2-cyanoethyl-[(4-ethoxyphenyl)methyl]carbamothioyl]benzamide
Openeye Name:N-[2-cyanoethyl-[(4-ethoxyphenyl)methyl]carbamothioyl]benzamide
CAS Name:N-[[2-cyanoethyl-[(4-ethoxyphenyl)methyl]amino]-sulfanylidenemethyl]benzamide
IUPAC Name:N-[2-cyanoethyl-[(4-ethoxyphenyl)methyl]carbamothioyl]benzamide
Traditional Name:N-[2-cyanoethyl-(4-ethoxybenzyl)thiocarbamoyl]benzamide
Formula: C20H21N3O2S
MolecularWeight: 367.46464
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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CN(CCC#N)C(=S)NC(=O)C2=CC=CC=C2


Isomeric SMILES

CCOC1=CC=C(C=C1)CN(CCC#N)C(=S)NC(=O)C2=CC=CC=C2


InChI

InChI=1S/C20H21N3O2S/c1-2-25-18-11-9-16(10-12-18)15-23(14-6-13-21)20(26)22-19(24)17-7-4-3-5-8-17/h3-5,7-12H,2,6,14-15H2,1H3,(H,22,24,26)


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