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

Systemtic Name: N-[3-[4-(diphenylmethyl)piperazin-1-yl]propyl]-3-methyl-6-sulfanylidene-cyclohexa-1,3-diene-1-carboxamide Openeye Name: N-[3-(4-benzhydrylpiperazin-1-yl)propyl]-3-methyl-6-thioxo-cyclohexa-1,3-diene-1-carboxamide CAS Name: N-[3-[4-(diphenylmethyl)-1-piperazinyl]propyl]-3-methyl-6-sulfanylidene-1-cyclohexa-1,3-dienecarboxamide IUPAC Name: N-[3-(4-benzhydrylpiperazin-1-yl)propyl]-3-methyl-6-sulfanylidenecyclohexa-1,3-diene-1-carboxamide Traditional Name: N-[3-(4-benzhydrylpiperazino)propyl]-3-methyl-6-thioxo-cyclohexa-1,3-diene-1-carboxamide Formula: C28H33N3OS MolecularWeight: 459.64612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(=S)C(=C1)C(=O)NCCCN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CCC(=S)C(=C1)C(=O)NCCCN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H33N3OS/c1-22-13-14-26(33)25(21-22)28(32)29-15-8-16-30-17-19-31(20-18-30)27(23-9-4-2-5-10-23)24-11-6-3-7-12-24/h2-7,9-13,21,27H,8,14-20H2,1H3,(H,29,32)