ethyl 2-azanyl-1-(2-phenylsulfanylethyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: ethyl 2-azanyl-1-(2-phenylsulfanylethyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: ethyl 2-amino-1-(2-phenylsulfanylethyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-[2-(phenylthio)ethyl]-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-1-(2-phenylsulfanylethyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-amino-1-[2-(phenylthio)ethyl]pyrrolo[3,2-b]quinoxaline-3-carboxylic acid ethyl ester Formula: C21H20N4O2S MolecularWeight: 392.4741

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CCSC4=CC=CC=C4)N

Isomeric SMILES

CCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CCSC4=CC=CC=C4)N

InChI

InChI=1S/C21H20N4O2S/c1-2-27-21(26)17-18-20(24-16-11-7-6-10-15(16)23-18)25(19(17)22)12-13-28-14-8-4-3-5-9-14/h3-11H,2,12-13,22H2,1H3