N-[[4-(3-methylbutoxy)phenyl]carbamothioyl]-4-phenethyloxy-benzamide

Systemtic Name: N-[[4-(3-methylbutoxy)phenyl]carbamothioyl]-4-phenethyloxy-benzamide Openeye Name: N-[(4-isopentyloxyphenyl)carbamothioyl]-4-phenethyloxy-benzamide CAS Name: N-[[4-(3-methylbutoxy)anilino]-sulfanylidenemethyl]-4-phenethyloxybenzamide IUPAC Name: N-[[4-(3-methylbutoxy)phenyl]carbamothioyl]-4-phenethyloxybenzamide Traditional Name: N-[(4-isoamoxyphenyl)thiocarbamoyl]-4-phenethyloxy-benzamide Formula: C27H30N2O3S MolecularWeight: 462.6037

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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