1-[4-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-3,3-diphenyl-propan-1-one

Systemtic Name: 1-[4-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-3,3-diphenyl-propan-1-one Openeye Name: 1-[4-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-3,3-diphenyl-propan-1-one CAS Name: 1-[4-(4,6-dimethyl-1,3-benzothiazol-2-yl)-1-piperazinyl]-3,3-diphenyl-1-propanone IUPAC Name: 1-[4-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-3,3-diphenylpropan-1-one Traditional Name: 1-[4-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperazino]-3,3-diphenyl-propan-1-one Formula: C28H29N3OS MolecularWeight: 455.61436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)N3CCN(CC3)C(=O)CC(C4=CC=CC=C4)C5=CC=CC=C5)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)N3CCN(CC3)C(=O)CC(C4=CC=CC=C4)C5=CC=CC=C5)C

InChI

InChI=1S/C28H29N3OS/c1-20-17-21(2)27-25(18-20)33-28(29-27)31-15-13-30(14-16-31)26(32)19-24(22-9-5-3-6-10-22)23-11-7-4-8-12-23/h3-12,17-18,24H,13-16,19H2,1-2H3