N-[2-[4-(diphenylmethyl)piperazin-1-yl]ethyl]-3-sulfanylidene-cyclohexa-1,5-diene-1-carboxamide

Systemtic Name: N-[2-[4-(diphenylmethyl)piperazin-1-yl]ethyl]-3-sulfanylidene-cyclohexa-1,5-diene-1-carboxamide Openeye Name: N-[2-(4-benzhydrylpiperazin-1-yl)ethyl]-3-thioxo-cyclohexa-1,5-diene-1-carboxamide CAS Name: N-[2-[4-(diphenylmethyl)-1-piperazinyl]ethyl]-3-sulfanylidene-1-cyclohexa-1,5-dienecarboxamide IUPAC Name: N-[2-(4-benzhydrylpiperazin-1-yl)ethyl]-3-sulfanylidenecyclohexa-1,5-diene-1-carboxamide Traditional Name: N-[2-(4-benzhydrylpiperazino)ethyl]-3-thioxo-cyclohexa-1,5-diene-1-carboxamide Formula: C26H29N3OS MolecularWeight: 431.59296

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCNC(=O)C2=CC(=S)CC=C2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CCNC(=O)C2=CC(=S)CC=C2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H29N3OS/c30-26(23-12-7-13-24(31)20-23)27-14-15-28-16-18-29(19-17-28)25(21-8-3-1-4-9-21)22-10-5-2-6-11-22/h1-12,20,25H,13-19H2,(H,27,30)