ethyl N-[2-(3-methylsulfanylphenyl)-3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-8-yl]carbamate

Systemtic Name: ethyl N-[2-(3-methylsulfanylphenyl)-3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-8-yl]carbamate Openeye Name: ethyl N-[2-(3-methylsulfanylphenyl)-3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-8-yl]carbamate CAS Name: N-[2-[3-(methylthio)phenyl]-3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-8-yl]carbamic acid ethyl ester IUPAC Name: ethyl N-[2-(3-methylsulfanylphenyl)-3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-8-yl]carbamate Traditional Name: N-[2-[3-(methylthio)phenyl]-3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-8-yl]carbamic acid ethyl ester Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CC2=C(C=C1)N3CCN(CC3=N2)C4=CC(=CC=C4)SC

Isomeric SMILES

CCOC(=O)NC1=CC2=C(C=C1)N3CCN(CC3=N2)C4=CC(=CC=C4)SC

InChI

InChI=1S/C20H22N4O2S/c1-3-26-20(25)21-14-7-8-18-17(11-14)22-19-13-23(9-10-24(18)19)15-5-4-6-16(12-15)27-2/h4-8,11-12H,3,9-10,13H2,1-2H3,(H,21,25)