[4-(3-methylpiperidin-1-yl)sulfonylphenyl]-[4-(6-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone

Systemtic Name: [4-(3-methylpiperidin-1-yl)sulfonylphenyl]-[4-(6-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Openeye Name: [4-[(3-methyl-1-piperidyl)sulfonyl]phenyl]-[4-(6-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone CAS Name: [4-[(3-methyl-1-piperidinyl)sulfonyl]phenyl]-[4-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1-piperazinyl]methanone IUPAC Name: [4-(3-methylpiperidin-1-yl)sulfonylphenyl]-[4-(6-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Traditional Name: [4-(6-mesyl-1,3-benzothiazol-2-yl)piperazino]-[4-(3-methylpiperidino)sulfonylphenyl]methanone Formula: C25H30N4O5S3 MolecularWeight: 562.7245

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=NC5=C(S4)C=C(C=C5)S(=O)(=O)C

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=NC5=C(S4)C=C(C=C5)S(=O)(=O)C

InChI

InChI=1S/C25H30N4O5S3/c1-18-4-3-11-29(17-18)37(33,34)20-7-5-19(6-8-20)24(30)27-12-14-28(15-13-27)25-26-22-10-9-21(36(2,31)32)16-23(22)35-25/h5-10,16,18H,3-4,11-15,17H2,1-2H3