2-azanyl-1-(3,4-dimethylphenyl)-N-(2-piperidin-1-ylethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-1-(3,4-dimethylphenyl)-N-(2-piperidin-1-ylethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-1-(3,4-dimethylphenyl)-N-[2-(1-piperidyl)ethyl]pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-1-(3,4-dimethylphenyl)-N-[2-(1-piperidinyl)ethyl]-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-1-(3,4-dimethylphenyl)-N-(2-piperidin-1-ylethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-(3,4-dimethylphenyl)-N-(2-piperidinoethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C26H30N6O MolecularWeight: 442.556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCCN5CCCCC5)N)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCCN5CCCCC5)N)C

InChI

InChI=1S/C26H30N6O/c1-17-10-11-19(16-18(17)2)32-24(27)22(26(33)28-12-15-31-13-6-3-7-14-31)23-25(32)30-21-9-5-4-8-20(21)29-23/h4-5,8-11,16H,3,6-7,12-15,27H2,1-2H3,(H,28,33)