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

Systemtic Name: N-[[3-(3-methylbutoxy)phenyl]carbamothioyl]-4-phenyl-benzamide Openeye Name: N-[(3-isopentyloxyphenyl)carbamothioyl]-4-phenyl-benzamide CAS Name: N-[[3-(3-methylbutoxy)anilino]-sulfanylidenemethyl]-4-phenylbenzamide IUPAC Name: N-[[3-(3-methylbutoxy)phenyl]carbamothioyl]-4-phenylbenzamide Traditional Name: N-[(3-isoamoxyphenyl)thiocarbamoyl]-4-phenyl-benzamide Formula: C25H26N2O2S MolecularWeight: 418.55114

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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)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C25H26N2O2S/c1-18(2)15-16-29-23-10-6-9-22(17-23)26-25(30)27-24(28)21-13-11-20(12-14-21)19-7-4-3-5-8-19/h3-14,17-18H,15-16H2,1-2H3,(H2,26,27,28,30)