2-azanyl-1-butyl-N-[(2R)-4-phenylbutan-2-yl]pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-1-butyl-N-[(2R)-4-phenylbutan-2-yl]pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-1-butyl-N-[(1R)-1-methyl-3-phenyl-propyl]pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-1-butyl-N-[(2R)-4-phenylbutan-2-yl]-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-1-butyl-N-[(2R)-4-phenylbutan-2-yl]pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-butyl-N-[(1R)-1-methyl-3-phenyl-propyl]pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C25H29N5O MolecularWeight: 415.53066

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)NC(C)CCC4=CC=CC=C4)N

Isomeric SMILES

CCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)N[C@H](C)CCC4=CC=CC=C4)N

InChI

InChI=1S/C25H29N5O/c1-3-4-16-30-23(26)21(22-24(30)29-20-13-9-8-12-19(20)28-22)25(31)27-17(2)14-15-18-10-6-5-7-11-18/h5-13,17H,3-4,14-16,26H2,1-2H3,(H,27,31)/t17-/m1/s1