N-(1,3-benzothiazol-2-yl)-3-(4-chlorophenyl)sulfanyl-N-(pyridin-2-ylmethyl)propanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-3-(4-chlorophenyl)sulfanyl-N-(pyridin-2-ylmethyl)propanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-3-(4-chlorophenyl)sulfanyl-N-(2-pyridylmethyl)propanamide CAS Name: N-(1,3-benzothiazol-2-yl)-3-[(4-chlorophenyl)thio]-N-(2-pyridinylmethyl)propanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-3-(4-chlorophenyl)sulfanyl-N-(pyridin-2-ylmethyl)propanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-3-[(4-chlorophenyl)thio]-N-(2-pyridylmethyl)propionamide Formula: C22H18ClN3OS2 MolecularWeight: 439.98082

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)N(CC3=CC=CC=N3)C(=O)CCSC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)N(CC3=CC=CC=N3)C(=O)CCSC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H18ClN3OS2/c23-16-8-10-18(11-9-16)28-14-12-21(27)26(15-17-5-3-4-13-24-17)22-25-19-6-1-2-7-20(19)29-22/h1-11,13H,12,14-15H2