6-[(3S)-3-(3-methylthiophen-2-yl)carbonylpiperidin-1-yl]sulfonyl-3H-1,3-benzothiazol-2-one

Systemtic Name: 6-[(3S)-3-(3-methylthiophen-2-yl)carbonylpiperidin-1-yl]sulfonyl-3H-1,3-benzothiazol-2-one Openeye Name: 6-[[(3S)-3-(3-methylthiophene-2-carbonyl)-1-piperidyl]sulfonyl]-3H-1,3-benzothiazol-2-one CAS Name: 6-[[(3S)-3-[(3-methyl-2-thiophenyl)-oxomethyl]-1-piperidinyl]sulfonyl]-3H-1,3-benzothiazol-2-one IUPAC Name: 6-[(3S)-3-(3-methylthiophene-2-carbonyl)piperidin-1-yl]sulfonyl-3H-1,3-benzothiazol-2-one Traditional Name: 6-[(3S)-3-(3-methylthiophene-2-carbonyl)piperidino]sulfonyl-3H-1,3-benzothiazol-2-one Formula: C18H18N2O4S3 MolecularWeight: 422.54152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(=O)C2CCCN(C2)S(=O)(=O)C3=CC4=C(C=C3)NC(=O)S4

Isomeric SMILES

CC1=C(SC=C1)C(=O)[C@H]2CCCN(C2)S(=O)(=O)C3=CC4=C(C=C3)NC(=O)S4

InChI

InChI=1S/C18H18N2O4S3/c1-11-6-8-25-17(11)16(21)12-3-2-7-20(10-12)27(23,24)13-4-5-14-15(9-13)26-18(22)19-14/h4-6,8-9,12H,2-3,7,10H2,1H3,(H,19,22)/t12-/m0/s1