N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-(4-methylpiperidin-1-yl)sulfonyl-N-(2-pyrazol-1-ylethyl)benzamide

Systemtic Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-(4-methylpiperidin-1-yl)sulfonyl-N-(2-pyrazol-1-ylethyl)benzamide Openeye Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-[(4-methyl-1-piperidyl)sulfonyl]-N-(2-pyrazol-1-ylethyl)benzamide CAS Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-[(4-methyl-1-piperidinyl)sulfonyl]-N-[2-(1-pyrazolyl)ethyl]benzamide IUPAC Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-(4-methylpiperidin-1-yl)sulfonyl-N-(2-pyrazol-1-ylethyl)benzamide Traditional Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-(4-methylpiperidino)sulfonyl-N-(2-pyrazol-1-ylethyl)benzamide Formula: C27H31N5O3S2 MolecularWeight: 537.69674

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N(CCN3C=CC=N3)C4=NC5=C(C=C(C=C5S4)C)C

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N(CCN3C=CC=N3)C4=NC5=C(C=C(C=C5S4)C)C

InChI

InChI=1S/C27H31N5O3S2/c1-19-9-13-31(14-10-19)37(34,35)23-7-5-22(6-8-23)26(33)32(16-15-30-12-4-11-28-30)27-29-25-21(3)17-20(2)18-24(25)36-27/h4-8,11-12,17-19H,9-10,13-16H2,1-3H3