3-(4-methoxyphenyl)sulfanyl-1-[4-(4-propan-2-yl-1,3-benzothiazol-2-yl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-(4-methoxyphenyl)sulfanyl-1-[4-(4-propan-2-yl-1,3-benzothiazol-2-yl)piperazin-1-yl]propan-1-one Openeye Name: 1-[4-(4-isopropyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-3-(4-methoxyphenyl)sulfanyl-propan-1-one CAS Name: 3-[(4-methoxyphenyl)thio]-1-[4-(4-propan-2-yl-1,3-benzothiazol-2-yl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(4-methoxyphenyl)sulfanyl-1-[4-(4-propan-2-yl-1,3-benzothiazol-2-yl)piperazin-1-yl]propan-1-one Traditional Name: 1-[4-(4-isopropyl-1,3-benzothiazol-2-yl)piperazino]-3-[(4-methoxyphenyl)thio]propan-1-one Formula: C24H29N3O2S2 MolecularWeight: 455.63596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)CCSC4=CC=C(C=C4)OC

Isomeric SMILES

CC(C)C1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)CCSC4=CC=C(C=C4)OC

InChI

InChI=1S/C24H29N3O2S2/c1-17(2)20-5-4-6-21-23(20)25-24(31-21)27-14-12-26(13-15-27)22(28)11-16-30-19-9-7-18(29-3)8-10-19/h4-10,17H,11-16H2,1-3H3