2-azanyl-N-phenethyl-1-[(E)-(4-propan-2-ylphenyl)methylideneamino]pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-N-phenethyl-1-[(E)-(4-propan-2-ylphenyl)methylideneamino]pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-1-[(E)-(4-isopropylphenyl)methyleneamino]-N-phenethyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-N-phenethyl-1-[(E)-(4-propan-2-ylphenyl)methylideneamino]-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-N-phenethyl-1-[(E)-(4-propan-2-ylphenyl)methylideneamino]pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-[(E)-(4-isopropylbenzylidene)amino]-N-phenethyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C29H28N6O MolecularWeight: 476.57222

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C=NN2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCCC5=CC=CC=C5)N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)/C=N/N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCCC5=CC=CC=C5)N

InChI

InChI=1S/C29H28N6O/c1-19(2)22-14-12-21(13-15-22)18-32-35-27(30)25(29(36)31-17-16-20-8-4-3-5-9-20)26-28(35)34-24-11-7-6-10-23(24)33-26/h3-15,18-19H,16-17,30H2,1-2H3,(H,31,36)/b32-18+