4-[4-(diphenylmethyl)piperazin-1-yl]-6,7-dimethyl-1-phenyl-2-sulfanylidene-1,3-diazepin-5-one

Systemtic Name: 4-[4-(diphenylmethyl)piperazin-1-yl]-6,7-dimethyl-1-phenyl-2-sulfanylidene-1,3-diazepin-5-one Openeye Name: 4-(4-benzhydrylpiperazin-1-yl)-6,7-dimethyl-1-phenyl-2-thioxo-1,3-diazepin-5-one CAS Name: 4-[4-(diphenylmethyl)-1-piperazinyl]-6,7-dimethyl-1-phenyl-2-sulfanylidene-1,3-diazepin-5-one IUPAC Name: 4-(4-benzhydrylpiperazin-1-yl)-6,7-dimethyl-1-phenyl-2-sulfanylidene-1,3-diazepin-5-one Traditional Name: 4-(4-benzhydrylpiperazino)-6,7-dimethyl-1-phenyl-2-thioxo-1,3-diazepin-5-one Formula: C30H30N4OS MolecularWeight: 494.6504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=S)N=C(C1=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C

Isomeric SMILES

CC1=C(N(C(=S)N=C(C1=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C

InChI

InChI=1S/C30H30N4OS/c1-22-23(2)34(26-16-10-5-11-17-26)30(36)31-29(28(22)35)33-20-18-32(19-21-33)27(24-12-6-3-7-13-24)25-14-8-4-9-15-25/h3-17,27H,18-21H2,1-2H3