N-[(4-butoxyphenyl)carbamothioyl]-3-propoxy-benzamide

Systemtic Name: N-[(4-butoxyphenyl)carbamothioyl]-3-propoxy-benzamide Openeye Name: N-[(4-butoxyphenyl)carbamothioyl]-3-propoxy-benzamide CAS Name: N-[(4-butoxyanilino)-sulfanylidenemethyl]-3-propoxybenzamide IUPAC Name: N-[(4-butoxyphenyl)carbamothioyl]-3-propoxybenzamide Traditional Name: N-[(4-butoxyphenyl)thiocarbamoyl]-3-propoxy-benzamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCCC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCCC

InChI

InChI=1S/C21H26N2O3S/c1-3-5-14-26-18-11-9-17(10-12-18)22-21(27)23-20(24)16-7-6-8-19(15-16)25-13-4-2/h6-12,15H,3-5,13-14H2,1-2H3,(H2,22,23,24,27)