2-[2-(4-chlorophenyl)sulfanylbutanoylamino]-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: 2-[2-(4-chlorophenyl)sulfanylbutanoylamino]-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 2-[2-(4-chlorophenyl)sulfanylbutanoylamino]-N-(3-pyridylmethyl)benzamide CAS Name: 2-[[2-[(4-chlorophenyl)thio]-1-oxobutyl]amino]-N-(3-pyridinylmethyl)benzamide IUPAC Name: 2-[2-(4-chlorophenyl)sulfanylbutanoylamino]-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 2-[2-[(4-chlorophenyl)thio]butanoylamino]-N-(3-pyridylmethyl)benzamide Formula: C23H22ClN3O2S MolecularWeight: 439.95768

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1C(=O)NCC2=CN=CC=C2)SC3=CC=C(C=C3)Cl

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1C(=O)NCC2=CN=CC=C2)SC3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H22ClN3O2S/c1-2-21(30-18-11-9-17(24)10-12-18)23(29)27-20-8-4-3-7-19(20)22(28)26-15-16-6-5-13-25-14-16/h3-14,21H,2,15H2,1H3,(H,26,28)(H,27,29)