N-(6-ethyl-1,3-benzothiazol-2-yl)-3-(phenylsulfonyl)-N-(pyridin-2-ylmethyl)propanamide

Systemtic Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-3-(phenylsulfonyl)-N-(pyridin-2-ylmethyl)propanamide Openeye Name: 3-(benzenesulfonyl)-N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(2-pyridylmethyl)propanamide CAS Name: 3-(benzenesulfonyl)-N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(2-pyridinylmethyl)propanamide IUPAC Name: 3-(benzenesulfonyl)-N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)propanamide Traditional Name: 3-besyl-N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(2-pyridylmethyl)propionamide Formula: C24H23N3O3S2 MolecularWeight: 465.58772

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)N(CC3=CC=CC=N3)C(=O)CCS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)N(CC3=CC=CC=N3)C(=O)CCS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H23N3O3S2/c1-2-18-11-12-21-22(16-18)31-24(26-21)27(17-19-8-6-7-14-25-19)23(28)13-15-32(29,30)20-9-4-3-5-10-20/h3-12,14,16H,2,13,15,17H2,1H3