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

Systemtic Name: 4-(4-methoxyphenyl)sulfonyl-1-[4-(4-propan-2-yl-1,3-benzothiazol-2-yl)piperazin-1-yl]butan-1-one Openeye Name: 1-[4-(4-isopropyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-4-(4-methoxyphenyl)sulfonyl-butan-1-one CAS Name: 4-(4-methoxyphenyl)sulfonyl-1-[4-(4-propan-2-yl-1,3-benzothiazol-2-yl)-1-piperazinyl]-1-butanone IUPAC Name: 4-(4-methoxyphenyl)sulfonyl-1-[4-(4-propan-2-yl-1,3-benzothiazol-2-yl)piperazin-1-yl]butan-1-one Traditional Name: 1-[4-(4-isopropyl-1,3-benzothiazol-2-yl)piperazino]-4-(4-methoxyphenyl)sulfonyl-butan-1-one Formula: C25H31N3O4S2 MolecularWeight: 501.66134

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H31N3O4S2/c1-18(2)21-6-4-7-22-24(21)26-25(33-22)28-15-13-27(14-16-28)23(29)8-5-17-34(30,31)20-11-9-19(32-3)10-12-20/h4,6-7,9-12,18H,5,8,13-17H2,1-3H3