2-azanyl-N-butan-2-yl-1-[(E)-(phenylmethylidene)amino]pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-N-butan-2-yl-1-[(E)-(phenylmethylidene)amino]pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-1-[(E)-benzylideneamino]-N-sec-butyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-N-butan-2-yl-1-[(E)-(phenylmethylene)amino]-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-1-[(E)-benzylideneamino]-N-butan-2-ylpyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-[(E)-benzalamino]-N-sec-butyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C22H22N6O MolecularWeight: 386.44968

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)N=CC4=CC=CC=C4)N

Isomeric SMILES

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

InChI

InChI=1S/C22H22N6O/c1-3-14(2)25-22(29)18-19-21(27-17-12-8-7-11-16(17)26-19)28(20(18)23)24-13-15-9-5-4-6-10-15/h4-14H,3,23H2,1-2H3,(H,25,29)/b24-13+