[4-(4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]methanone

Systemtic Name: [4-(4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]methanone Openeye Name: [4-(4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-[4-[(2-methyl-1-piperidyl)sulfonyl]phenyl]methanone CAS Name: [4-(4-methyl-1,3-benzothiazol-2-yl)-1-piperazinyl]-[4-[(2-methyl-1-piperidinyl)sulfonyl]phenyl]methanone IUPAC Name: [4-(4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]methanone Traditional Name: [4-(4-methyl-1,3-benzothiazol-2-yl)piperazino]-[4-(2-methylpiperidino)sulfonylphenyl]methanone Formula: C25H30N4O3S2 MolecularWeight: 498.6607

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=NC5=C(C=CC=C5S4)C

Isomeric SMILES

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=NC5=C(C=CC=C5S4)C

InChI

InChI=1S/C25H30N4O3S2/c1-18-6-5-8-22-23(18)26-25(33-22)28-16-14-27(15-17-28)24(30)20-9-11-21(12-10-20)34(31,32)29-13-4-3-7-19(29)2/h5-6,8-12,19H,3-4,7,13-17H2,1-2H3