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

Systemtic Name: N-[[3-(3-methylbutoxy)phenyl]carbamothioyl]-4-phenethyloxy-benzamide Openeye Name: N-[(3-isopentyloxyphenyl)carbamothioyl]-4-phenethyloxy-benzamide CAS Name: N-[[3-(3-methylbutoxy)anilino]-sulfanylidenemethyl]-4-phenethyloxybenzamide IUPAC Name: N-[[3-(3-methylbutoxy)phenyl]carbamothioyl]-4-phenethyloxybenzamide Traditional Name: N-[(3-isoamoxyphenyl)thiocarbamoyl]-4-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=C(C=C2)OCCC3=CC=CC=C3

Isomeric SMILES

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

InChI

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