cyclohexyl 2-azanyl-1-(thiophen-2-ylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: cyclohexyl 2-azanyl-1-(thiophen-2-ylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: cyclohexyl 2-amino-1-(2-thienylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-(thiophen-2-ylmethyl)-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid cyclohexyl ester IUPAC Name: cyclohexyl 2-amino-1-(thiophen-2-ylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-amino-1-(2-thenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylic acid cyclohexyl ester Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CC5=CC=CS5)N

Isomeric SMILES

C1CCC(CC1)OC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CC5=CC=CS5)N

InChI

InChI=1S/C22H22N4O2S/c23-20-18(22(27)28-14-7-2-1-3-8-14)19-21(26(20)13-15-9-6-12-29-15)25-17-11-5-4-10-16(17)24-19/h4-6,9-12,14H,1-3,7-8,13,23H2