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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(=S)C(=C1)C(=O)NCCCCN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CCC(=S)C(=C1)C(=O)NCCCCN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

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