[4-(4,7-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(1-thiophen-2-ylsulfonylpiperidin-2-yl)methanone

Systemtic Name: [4-(4,7-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(1-thiophen-2-ylsulfonylpiperidin-2-yl)methanone Openeye Name: [4-(4,7-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-[1-(2-thienylsulfonyl)-2-piperidyl]methanone CAS Name: [4-(4,7-dimethyl-1,3-benzothiazol-2-yl)-1-piperazinyl]-(1-thiophen-2-ylsulfonyl-2-piperidinyl)methanone IUPAC Name: [4-(4,7-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(1-thiophen-2-ylsulfonylpiperidin-2-yl)methanone Traditional Name: [4-(4,7-dimethyl-1,3-benzothiazol-2-yl)piperazino]-[1-(2-thienylsulfonyl)-2-piperidyl]methanone Formula: C23H28N4O3S3 MolecularWeight: 504.68842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)C)SC(=N2)N3CCN(CC3)C(=O)C4CCCCN4S(=O)(=O)C5=CC=CS5

Isomeric SMILES

CC1=C2C(=C(C=C1)C)SC(=N2)N3CCN(CC3)C(=O)C4CCCCN4S(=O)(=O)C5=CC=CS5

InChI

InChI=1S/C23H28N4O3S3/c1-16-8-9-17(2)21-20(16)24-23(32-21)26-13-11-25(12-14-26)22(28)18-6-3-4-10-27(18)33(29,30)19-7-5-15-31-19/h5,7-9,15,18H,3-4,6,10-14H2,1-2H3