methyl (2R)-3-(aminocarbonylhydrazinylidene)-4-[(2-ethyl-6-propan-2-yl-phenyl)amino]-4-oxidanylidene-2-quinoxalin-2-yl-butanoate

Systemtic Name: methyl (2R)-3-(aminocarbonylhydrazinylidene)-4-[(2-ethyl-6-propan-2-yl-phenyl)amino]-4-oxidanylidene-2-quinoxalin-2-yl-butanoate Openeye Name: methyl (2R)-3-(carbamoylhydrazono)-4-(2-ethyl-6-isopropyl-anilino)-4-oxo-2-quinoxalin-2-yl-butanoate CAS Name: (2R)-3-(carbamoylhydrazinylidene)-4-(2-ethyl-6-propan-2-ylanilino)-4-oxo-2-(2-quinoxalinyl)butanoic acid methyl ester IUPAC Name: methyl (2R)-3-(carbamoylhydrazinylidene)-4-(2-ethyl-6-propan-2-ylanilino)-4-oxo-2-quinoxalin-2-ylbutanoate Traditional Name: (2R)-4-(2-ethyl-6-isopropyl-anilino)-4-keto-2-quinoxalin-2-yl-3-semicarbazono-butyric acid methyl ester Formula: C25H28N6O4 MolecularWeight: 476.52762

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)C(C)C)NC(=O)C(=NNC(=O)N)C(C2=NC3=CC=CC=C3N=C2)C(=O)OC

Isomeric SMILES

CCC1=C(C(=CC=C1)C(C)C)NC(=O)C(=NNC(=O)N)[C@@H](C2=NC3=CC=CC=C3N=C2)C(=O)OC

InChI

InChI=1S/C25H28N6O4/c1-5-15-9-8-10-16(14(2)3)21(15)29-23(32)22(30-31-25(26)34)20(24(33)35-4)19-13-27-17-11-6-7-12-18(17)28-19/h6-14,20H,5H2,1-4H3,(H,29,32)(H3,26,31,34)/t20-/m1/s1