N-[[2-(4-methylpiperidin-1-yl)carbonylphenyl]carbamothioyl]-4-phenethyloxy-benzamide

Systemtic Name: N-[[2-(4-methylpiperidin-1-yl)carbonylphenyl]carbamothioyl]-4-phenethyloxy-benzamide Openeye Name: N-[[2-(4-methylpiperidine-1-carbonyl)phenyl]carbamothioyl]-4-phenethyloxy-benzamide CAS Name: N-[[2-[(4-methyl-1-piperidinyl)-oxomethyl]anilino]-sulfanylidenemethyl]-4-phenethyloxybenzamide IUPAC Name: N-[[2-(4-methylpiperidine-1-carbonyl)phenyl]carbamothioyl]-4-phenethyloxybenzamide Traditional Name: N-[[2-(4-methylpiperidine-1-carbonyl)phenyl]thiocarbamoyl]-4-phenethyloxy-benzamide Formula: C29H31N3O3S MolecularWeight: 501.63974

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C2=CC=CC=C2NC(=S)NC(=O)C3=CC=C(C=C3)OCCC4=CC=CC=C4

Isomeric SMILES

CC1CCN(CC1)C(=O)C2=CC=CC=C2NC(=S)NC(=O)C3=CC=C(C=C3)OCCC4=CC=CC=C4

InChI

InChI=1S/C29H31N3O3S/c1-21-15-18-32(19-16-21)28(34)25-9-5-6-10-26(25)30-29(36)31-27(33)23-11-13-24(14-12-23)35-20-17-22-7-3-2-4-8-22/h2-14,21H,15-20H2,1H3,(H2,30,31,33,36)