N-(7-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)sulfanyl-N-(pyridin-2-ylmethyl)propanamide

Systemtic Name: N-(7-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)sulfanyl-N-(pyridin-2-ylmethyl)propanamide Openeye Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)sulfanyl-N-(2-pyridylmethyl)propanamide CAS Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-3-[(4-methoxyphenyl)thio]-N-(2-pyridinylmethyl)propanamide IUPAC Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)sulfanyl-N-(pyridin-2-ylmethyl)propanamide Traditional Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-3-[(4-methoxyphenyl)thio]-N-(2-pyridylmethyl)propionamide Formula: C24H22ClN3O2S2 MolecularWeight: 484.03338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)Cl)SC(=N2)N(CC3=CC=CC=N3)C(=O)CCSC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=C2C(=C(C=C1)Cl)SC(=N2)N(CC3=CC=CC=N3)C(=O)CCSC4=CC=C(C=C4)OC

InChI

InChI=1S/C24H22ClN3O2S2/c1-16-6-11-20(25)23-22(16)27-24(32-23)28(15-17-5-3-4-13-26-17)21(29)12-14-31-19-9-7-18(30-2)8-10-19/h3-11,13H,12,14-15H2,1-2H3