2-[(4-methylphenyl)methylsulfanylmethyl]-3-oxidanylidene-N-prop-2-enyl-2,4-dihydro-1H-quinoxaline-6-carboxamide

Systemtic Name: 2-[(4-methylphenyl)methylsulfanylmethyl]-3-oxidanylidene-N-prop-2-enyl-2,4-dihydro-1H-quinoxaline-6-carboxamide Openeye Name: N-allyl-3-oxo-2-(p-tolylmethylsulfanylmethyl)-2,4-dihydro-1H-quinoxaline-6-carboxamide CAS Name: 2-[[(4-methylphenyl)methylthio]methyl]-3-oxo-N-prop-2-enyl-2,4-dihydro-1H-quinoxaline-6-carboxamide IUPAC Name: 2-[(4-methylphenyl)methylsulfanylmethyl]-3-oxo-N-prop-2-enyl-2,4-dihydro-1H-quinoxaline-6-carboxamide Traditional Name: N-allyl-3-keto-2-[[(4-methylbenzyl)thio]methyl]-2,4-dihydro-1H-quinoxaline-6-carboxamide Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSCC2C(=O)NC3=C(N2)C=CC(=C3)C(=O)NCC=C

Isomeric SMILES

CC1=CC=C(C=C1)CSCC2C(=O)NC3=C(N2)C=CC(=C3)C(=O)NCC=C

InChI

InChI=1S/C21H23N3O2S/c1-3-10-22-20(25)16-8-9-17-18(11-16)24-21(26)19(23-17)13-27-12-15-6-4-14(2)5-7-15/h3-9,11,19,23H,1,10,12-13H2,2H3,(H,22,25)(H,24,26)