N-[4-(diphenylmethyl)piperazin-1-yl]carbothioyl-4-(3-methylbutoxy)benzamide

Systemtic Name: N-[4-(diphenylmethyl)piperazin-1-yl]carbothioyl-4-(3-methylbutoxy)benzamide Openeye Name: N-(4-benzhydrylpiperazine-1-carbothioyl)-4-isopentyloxy-benzamide CAS Name: N-[[4-(diphenylmethyl)-1-piperazinyl]-sulfanylidenemethyl]-4-(3-methylbutoxy)benzamide IUPAC Name: N-(4-benzhydrylpiperazine-1-carbothioyl)-4-(3-methylbutoxy)benzamide Traditional Name: N-(4-benzhydrylpiperazine-1-carbothioyl)-4-isoamoxy-benzamide Formula: C30H35N3O2S MolecularWeight: 501.6828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)C(=O)NC(=S)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)C(=O)NC(=S)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C30H35N3O2S/c1-23(2)17-22-35-27-15-13-26(14-16-27)29(34)31-30(36)33-20-18-32(19-21-33)28(24-9-5-3-6-10-24)25-11-7-4-8-12-25/h3-16,23,28H,17-22H2,1-2H3,(H,31,34,36)