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N-[2,5-diethoxy-4-[(phenylmethyl)carbamothioylamino]phenyl]-3-methyl-benzamide

N-[2,5-diethoxy-4-[(phenylmethyl)carbamothioylamino]phenyl]-3-methyl-benzamide

Systemtic Name:N-[2,5-diethoxy-4-[(phenylmethyl)carbamothioylamino]phenyl]-3-methyl-benzamide
Openeye Name:N-[4-(benzylcarbamothioylamino)-2,5-diethoxy-phenyl]-3-methyl-benzamide
CAS Name:N-[2,5-diethoxy-4-[[[(phenylmethyl)amino]-sulfanylidenemethyl]amino]phenyl]-3-methylbenzamide
IUPAC Name:N-[4-(benzylcarbamothioylamino)-2,5-diethoxyphenyl]-3-methylbenzamide
Traditional Name:N-[4-(benzylthiocarbamoylamino)-2,5-diethoxy-phenyl]-3-methyl-benzamide
Formula: C26H29N3O3S
MolecularWeight: 463.59176
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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1NC(=O)C2=CC(=CC=C2)C)OCC)NC(=S)NCC3=CC=CC=C3


Isomeric SMILES

CCOC1=CC(=C(C=C1NC(=O)C2=CC(=CC=C2)C)OCC)NC(=S)NCC3=CC=CC=C3


InChI

InChI=1S/C26H29N3O3S/c1-4-31-23-16-22(29-26(33)27-17-19-11-7-6-8-12-19)24(32-5-2)15-21(23)28-25(30)20-13-9-10-18(3)14-20/h6-16H,4-5,17H2,1-3H3,(H,28,30)(H2,27,29,33)


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