2-[(2-chlorophenyl)methylsulfanylmethyl]-3-oxidanylidene-N-(pyridin-3-ylmethyl)-2,4-dihydro-1H-quinoxaline-6-carboxamide

Systemtic Name: 2-[(2-chlorophenyl)methylsulfanylmethyl]-3-oxidanylidene-N-(pyridin-3-ylmethyl)-2,4-dihydro-1H-quinoxaline-6-carboxamide Openeye Name: 2-[(2-chlorophenyl)methylsulfanylmethyl]-3-oxo-N-(3-pyridylmethyl)-2,4-dihydro-1H-quinoxaline-6-carboxamide CAS Name: 2-[[(2-chlorophenyl)methylthio]methyl]-3-oxo-N-(3-pyridinylmethyl)-2,4-dihydro-1H-quinoxaline-6-carboxamide IUPAC Name: 2-[(2-chlorophenyl)methylsulfanylmethyl]-3-oxo-N-(pyridin-3-ylmethyl)-2,4-dihydro-1H-quinoxaline-6-carboxamide Traditional Name: 2-[[(2-chlorobenzyl)thio]methyl]-3-keto-N-(3-pyridylmethyl)-2,4-dihydro-1H-quinoxaline-6-carboxamide Formula: C23H21ClN4O2S MolecularWeight: 452.95644

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSCC2C(=O)NC3=C(N2)C=CC(=C3)C(=O)NCC4=CN=CC=C4)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CSCC2C(=O)NC3=C(N2)C=CC(=C3)C(=O)NCC4=CN=CC=C4)Cl

InChI

InChI=1S/C23H21ClN4O2S/c24-18-6-2-1-5-17(18)13-31-14-21-23(30)28-20-10-16(7-8-19(20)27-21)22(29)26-12-15-4-3-9-25-11-15/h1-11,21,27H,12-14H2,(H,26,29)(H,28,30)