N-(1,3-benzothiazol-2-yl)-4-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-(pyridin-2-ylmethyl)benzamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-4-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-(pyridin-2-ylmethyl)benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-4-[(3,5-dimethyl-1-piperidyl)sulfonyl]-N-(2-pyridylmethyl)benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-4-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-N-(2-pyridinylmethyl)benzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-4-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-(pyridin-2-ylmethyl)benzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-4-(3,5-dimethylpiperidino)sulfonyl-N-(2-pyridylmethyl)benzamide Formula: C27H28N4O3S2 MolecularWeight: 520.66622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N(CC3=CC=CC=N3)C4=NC5=CC=CC=C5S4)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N(CC3=CC=CC=N3)C4=NC5=CC=CC=C5S4)C

InChI

InChI=1S/C27H28N4O3S2/c1-19-15-20(2)17-30(16-19)36(33,34)23-12-10-21(11-13-23)26(32)31(18-22-7-5-6-14-28-22)27-29-24-8-3-4-9-25(24)35-27/h3-14,19-20H,15-18H2,1-2H3