1-[4-(diphenylmethyl)piperazin-1-yl]-5-(4,5-diphenyl-1-prop-2-enyl-imidazol-2-yl)sulfanyl-pentan-1-one

Systemtic Name: 1-[4-(diphenylmethyl)piperazin-1-yl]-5-(4,5-diphenyl-1-prop-2-enyl-imidazol-2-yl)sulfanyl-pentan-1-one Openeye Name: 5-(1-allyl-4,5-diphenyl-imidazol-2-yl)sulfanyl-1-(4-benzhydrylpiperazin-1-yl)pentan-1-one CAS Name: 1-[4-(diphenylmethyl)-1-piperazinyl]-5-[(4,5-diphenyl-1-prop-2-enyl-2-imidazolyl)thio]-1-pentanone IUPAC Name: 1-(4-benzhydrylpiperazin-1-yl)-5-(4,5-diphenyl-1-prop-2-enylimidazol-2-yl)sulfanylpentan-1-one Traditional Name: 5-[(1-allyl-4,5-diphenyl-imidazol-2-yl)thio]-1-(4-benzhydrylpiperazino)pentan-1-one Formula: C40H42N4OS MolecularWeight: 626.85268

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=C(N=C1SCCCCC(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C=CCN1C(=C(N=C1SCCCCC(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C40H42N4OS/c1-2-26-44-39(35-23-13-6-14-24-35)37(32-17-7-3-8-18-32)41-40(44)46-31-16-15-25-36(45)42-27-29-43(30-28-42)38(33-19-9-4-10-20-33)34-21-11-5-12-22-34/h2-14,17-24,38H,1,15-16,25-31H2