4-azanyl-N-[4-[(2-chloranyl-6-methyl-phenyl)amino]imidazo[1,5-a]quinoxalin-7-yl]butanamide

Systemtic Name: 4-azanyl-N-[4-[(2-chloranyl-6-methyl-phenyl)amino]imidazo[1,5-a]quinoxalin-7-yl]butanamide Openeye Name: 4-amino-N-[4-(2-chloro-6-methyl-anilino)imidazo[1,5-a]quinoxalin-7-yl]butanamide CAS Name: 4-amino-N-[4-(2-chloro-6-methylanilino)-7-imidazo[1,5-a]quinoxalinyl]butanamide IUPAC Name: 4-amino-N-[4-(2-chloro-6-methylanilino)imidazo[1,5-a]quinoxalin-7-yl]butanamide Traditional Name: 4-amino-N-[4-(2-chloro-6-methyl-anilino)imidazo[1,5-a]quinoxalin-7-yl]butyramide Formula: C21H21ClN6O MolecularWeight: 408.88404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)Cl)NC2=NC3=C(C=CC(=C3)NC(=O)CCCN)N4C2=CN=C4

Isomeric SMILES

CC1=C(C(=CC=C1)Cl)NC2=NC3=C(C=CC(=C3)NC(=O)CCCN)N4C2=CN=C4

InChI

InChI=1S/C21H21ClN6O/c1-13-4-2-5-15(22)20(13)27-21-18-11-24-12-28(18)17-8-7-14(10-16(17)26-21)25-19(29)6-3-9-23/h2,4-5,7-8,10-12H,3,6,9,23H2,1H3,(H,25,29)(H,26,27)