(4R)-4-[4-(diphenylmethyl)piperazin-1-yl]carbonyl-1,2,5-dithiazecan-6-one

Systemtic Name: (4R)-4-[4-(diphenylmethyl)piperazin-1-yl]carbonyl-1,2,5-dithiazecan-6-one Openeye Name: (4R)-4-(4-benzhydrylpiperazine-1-carbonyl)-1,2,5-dithiazecan-6-one CAS Name: (4R)-4-[[4-(diphenylmethyl)-1-piperazinyl]-oxomethyl]-1,2,5-dithiazecan-6-one IUPAC Name: (4R)-4-(4-benzhydrylpiperazine-1-carbonyl)-1,2,5-dithiazecan-6-one Traditional Name: (4R)-4-(4-benzhydrylpiperazine-1-carbonyl)-1,2,5-dithiazecan-6-one Formula: C25H31N3O2S2 MolecularWeight: 469.66254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCSSCC(NC(=O)C1)C(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CCSSC[C@H](NC(=O)C1)C(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H31N3O2S2/c29-23-13-7-8-18-31-32-19-22(26-23)25(30)28-16-14-27(15-17-28)24(20-9-3-1-4-10-20)21-11-5-2-6-12-21/h1-6,9-12,22,24H,7-8,13-19H2,(H,26,29)/t22-/m0/s1