N-[4-[4-(diphenylmethyl)piperazin-1-yl]butyl]-5-methyl-6-sulfanylidene-cyclohexa-1,3-diene-1-carboxamide

Systemtic Name: N-[4-[4-(diphenylmethyl)piperazin-1-yl]butyl]-5-methyl-6-sulfanylidene-cyclohexa-1,3-diene-1-carboxamide Openeye Name: N-[4-(4-benzhydrylpiperazin-1-yl)butyl]-5-methyl-6-thioxo-cyclohexa-1,3-diene-1-carboxamide CAS Name: N-[4-[4-(diphenylmethyl)-1-piperazinyl]butyl]-5-methyl-6-sulfanylidene-1-cyclohexa-1,3-dienecarboxamide IUPAC Name: N-[4-(4-benzhydrylpiperazin-1-yl)butyl]-5-methyl-6-sulfanylidenecyclohexa-1,3-diene-1-carboxamide Traditional Name: N-[4-(4-benzhydrylpiperazino)butyl]-5-methyl-6-thioxo-cyclohexa-1,3-diene-1-carboxamide Formula: C29H35N3OS MolecularWeight: 473.6727

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=CC=C(C1=S)C(=O)NCCCCN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1C=CC=C(C1=S)C(=O)NCCCCN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H35N3OS/c1-23-11-10-16-26(28(23)34)29(33)30-17-8-9-18-31-19-21-32(22-20-31)27(24-12-4-2-5-13-24)25-14-6-3-7-15-25/h2-7,10-16,23,27H,8-9,17-22H2,1H3,(H,30,33)