2-[(2,5-dimethylphenyl)methylsulfanylmethyl]-3-oxidanylidene-N-prop-2-enyl-2,4-dihydro-1H-quinoxaline-6-carboxamide

Systemtic Name: 2-[(2,5-dimethylphenyl)methylsulfanylmethyl]-3-oxidanylidene-N-prop-2-enyl-2,4-dihydro-1H-quinoxaline-6-carboxamide Openeye Name: N-allyl-2-[(2,5-dimethylphenyl)methylsulfanylmethyl]-3-oxo-2,4-dihydro-1H-quinoxaline-6-carboxamide CAS Name: 2-[[(2,5-dimethylphenyl)methylthio]methyl]-3-oxo-N-prop-2-enyl-2,4-dihydro-1H-quinoxaline-6-carboxamide IUPAC Name: 2-[(2,5-dimethylphenyl)methylsulfanylmethyl]-3-oxo-N-prop-2-enyl-2,4-dihydro-1H-quinoxaline-6-carboxamide Traditional Name: N-allyl-2-[[(2,5-dimethylbenzyl)thio]methyl]-3-keto-2,4-dihydro-1H-quinoxaline-6-carboxamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3O2S/c1-4-9-23-21(26)16-7-8-18-19(11-16)25-22(27)20(24-18)13-28-12-17-10-14(2)5-6-15(17)3/h4-8,10-11,20,24H,1,9,12-13H2,2-3H3,(H,23,26)(H,25,27)