methyl 2-[2-[(2S)-3-oxidanylidene-2,4-dihydro-1H-quinoxalin-2-yl]ethanoylamino]-5-propyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[2-[(2S)-3-oxidanylidene-2,4-dihydro-1H-quinoxalin-2-yl]ethanoylamino]-5-propyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[2-[(2S)-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl]acetyl]amino]-5-propyl-thiophene-3-carboxylate CAS Name: 2-[[1-oxo-2-[(2S)-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl]ethyl]amino]-5-propyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-[(2S)-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl]acetyl]amino]-5-propylthiophene-3-carboxylate Traditional Name: 2-[[2-[(2S)-3-keto-2,4-dihydro-1H-quinoxalin-2-yl]acetyl]amino]-5-propyl-thiophene-3-carboxylic acid methyl ester Formula: C19H21N3O4S MolecularWeight: 387.45274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(S1)NC(=O)CC2C(=O)NC3=CC=CC=C3N2)C(=O)OC

Isomeric SMILES

CCCC1=CC(=C(S1)NC(=O)C[C@H]2C(=O)NC3=CC=CC=C3N2)C(=O)OC

InChI

InChI=1S/C19H21N3O4S/c1-3-6-11-9-12(19(25)26-2)18(27-11)22-16(23)10-15-17(24)21-14-8-5-4-7-13(14)20-15/h4-5,7-9,15,20H,3,6,10H2,1-2H3,(H,21,24)(H,22,23)/t15-/m0/s1