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

Systemtic Name: N-[4-(diphenylmethyl)piperazin-1-yl]carbothioyl-4-pentoxy-benzamide Openeye Name: N-(4-benzhydrylpiperazine-1-carbothioyl)-4-pentoxy-benzamide CAS Name: N-[[4-(diphenylmethyl)-1-piperazinyl]-sulfanylidenemethyl]-4-pentoxybenzamide IUPAC Name: N-(4-benzhydrylpiperazine-1-carbothioyl)-4-pentoxybenzamide Traditional Name: 4-amoxy-N-(4-benzhydrylpiperazine-1-carbothioyl)benzamide Formula: C30H35N3O2S MolecularWeight: 501.6828

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C30H35N3O2S/c1-2-3-10-23-35-27-17-15-26(16-18-27)29(34)31-30(36)33-21-19-32(20-22-33)28(24-11-6-4-7-12-24)25-13-8-5-9-14-25/h4-9,11-18,28H,2-3,10,19-23H2,1H3,(H,31,34,36)