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

Systemtic Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-(2-methylpiperidin-1-yl)sulfonyl-N-(pyridin-2-ylmethyl)benzamide Openeye Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-[(2-methyl-1-piperidyl)sulfonyl]-N-(2-pyridylmethyl)benzamide CAS Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-[(2-methyl-1-piperidinyl)sulfonyl]-N-(2-pyridinylmethyl)benzamide IUPAC Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-(2-methylpiperidin-1-yl)sulfonyl-N-(pyridin-2-ylmethyl)benzamide Traditional Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-(2-methylpiperidino)sulfonyl-N-(2-pyridylmethyl)benzamide Formula: C28H30N4O3S2 MolecularWeight: 534.6928

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)N(CC3=CC=CC=N3)C4=NC5=C(C=C(C=C5S4)C)C

Isomeric SMILES

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)N(CC3=CC=CC=N3)C4=NC5=C(C=C(C=C5S4)C)C

InChI

InChI=1S/C28H30N4O3S2/c1-19-16-20(2)26-25(17-19)36-28(30-26)31(18-23-9-4-6-14-29-23)27(33)22-10-12-24(13-11-22)37(34,35)32-15-7-5-8-21(32)3/h4,6,9-14,16-17,21H,5,7-8,15,18H2,1-3H3