3,4,5-triethoxy-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide

Systemtic Name: 3,4,5-triethoxy-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide Openeye Name: 3,4,5-triethoxy-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide CAS Name: 3,4,5-triethoxy-N-[[4-(1-pyrrolidinyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3,4,5-triethoxy-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide Traditional Name: 3,4,5-triethoxy-N-[(4-pyrrolidinophenyl)thiocarbamoyl]benzamide Formula: C24H31N3O4S MolecularWeight: 457.58564

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC(=S)NC2=CC=C(C=C2)N3CCCC3

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC(=S)NC2=CC=C(C=C2)N3CCCC3

InChI

InChI=1S/C24H31N3O4S/c1-4-29-20-15-17(16-21(30-5-2)22(20)31-6-3)23(28)26-24(32)25-18-9-11-19(12-10-18)27-13-7-8-14-27/h9-12,15-16H,4-8,13-14H2,1-3H3,(H2,25,26,28,32)