N-[[3-(3-methylbutoxy)phenyl]carbamothioyl]-3-phenethyloxy-benzamide

Systemtic Name: N-[[3-(3-methylbutoxy)phenyl]carbamothioyl]-3-phenethyloxy-benzamide Openeye Name: N-[(3-isopentyloxyphenyl)carbamothioyl]-3-phenethyloxy-benzamide CAS Name: N-[[3-(3-methylbutoxy)anilino]-sulfanylidenemethyl]-3-phenethyloxybenzamide IUPAC Name: N-[[3-(3-methylbutoxy)phenyl]carbamothioyl]-3-phenethyloxybenzamide Traditional Name: N-[(3-isoamoxyphenyl)thiocarbamoyl]-3-phenethyloxy-benzamide Formula: C27H30N2O3S MolecularWeight: 462.6037

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=CC(=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCCC3=CC=CC=C3

Isomeric SMILES

CC(C)CCOC1=CC=CC(=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCCC3=CC=CC=C3

InChI

InChI=1S/C27H30N2O3S/c1-20(2)14-16-31-25-13-7-11-23(19-25)28-27(33)29-26(30)22-10-6-12-24(18-22)32-17-15-21-8-4-3-5-9-21/h3-13,18-20H,14-17H2,1-2H3,(H2,28,29,30,33)