N-[(4-butylphenyl)carbamothioyl]-3-propan-2-yloxy-benzamide

Systemtic Name: N-[(4-butylphenyl)carbamothioyl]-3-propan-2-yloxy-benzamide Openeye Name: N-[(4-butylphenyl)carbamothioyl]-3-isopropoxy-benzamide CAS Name: N-[(4-butylanilino)-sulfanylidenemethyl]-3-propan-2-yloxybenzamide IUPAC Name: N-[(4-butylphenyl)carbamothioyl]-3-propan-2-yloxybenzamide Traditional Name: N-[(4-butylphenyl)thiocarbamoyl]-3-isopropoxy-benzamide Formula: C21H26N2O2S MolecularWeight: 370.50834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OC(C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OC(C)C

InChI

InChI=1S/C21H26N2O2S/c1-4-5-7-16-10-12-18(13-11-16)22-21(26)23-20(24)17-8-6-9-19(14-17)25-15(2)3/h6,8-15H,4-5,7H2,1-3H3,(H2,22,23,24,26)