N-[2,5-diethoxy-4-[(4-methylphenyl)carbamothioylamino]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[2,5-diethoxy-4-[(4-methylphenyl)carbamothioylamino]phenyl]thiophene-2-carboxamide Openeye Name: N-[2,5-diethoxy-4-(p-tolylcarbamothioylamino)phenyl]thiophene-2-carboxamide CAS Name: N-[2,5-diethoxy-4-[[(4-methylanilino)-sulfanylidenemethyl]amino]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[2,5-diethoxy-4-[(4-methylphenyl)carbamothioylamino]phenyl]thiophene-2-carboxamide Traditional Name: N-[2,5-diethoxy-4-(p-tolylthiocarbamoylamino)phenyl]thiophene-2-carboxamide Formula: C23H25N3O3S2 MolecularWeight: 455.5929

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1NC(=O)C2=CC=CS2)OCC)NC(=S)NC3=CC=C(C=C3)C

Isomeric SMILES

CCOC1=CC(=C(C=C1NC(=O)C2=CC=CS2)OCC)NC(=S)NC3=CC=C(C=C3)C

InChI

InChI=1S/C23H25N3O3S2/c1-4-28-19-14-18(26-23(30)24-16-10-8-15(3)9-11-16)20(29-5-2)13-17(19)25-22(27)21-7-6-12-31-21/h6-14H,4-5H2,1-3H3,(H,25,27)(H2,24,26,30)