2-azanyl-N-[(2S)-6-methylheptan-2-yl]-1-phenyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-N-[(2S)-6-methylheptan-2-yl]-1-phenyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-N-[(1S)-1,5-dimethylhexyl]-1-phenyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-N-[(2S)-6-methylheptan-2-yl]-1-phenyl-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-N-[(2S)-6-methylheptan-2-yl]-1-phenylpyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-N-[(1S)-1,5-dimethylhexyl]-1-phenyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C25H29N5O MolecularWeight: 415.53066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)NC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC=CC=C4)N

Isomeric SMILES

C[C@@H](CCCC(C)C)NC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC=CC=C4)N

InChI

InChI=1S/C25H29N5O/c1-16(2)10-9-11-17(3)27-25(31)21-22-24(29-20-15-8-7-14-19(20)28-22)30(23(21)26)18-12-5-4-6-13-18/h4-8,12-17H,9-11,26H2,1-3H3,(H,27,31)/t17-/m0/s1