methyl 2-[2-(4-cyano-3-ethyl-pyrido[1,2-a]benzimidazol-1-yl)sulfanylethanoylamino]ethanoate

Systemtic Name: methyl 2-[2-(4-cyano-3-ethyl-pyrido[1,2-a]benzimidazol-1-yl)sulfanylethanoylamino]ethanoate Openeye Name: methyl 2-[[2-(4-cyano-3-ethyl-pyrido[1,2-a]benzimidazol-1-yl)sulfanylacetyl]amino]acetate CAS Name: 2-[[2-[(4-cyano-3-ethyl-1-pyrido[1,2-a]benzimidazolyl)thio]-1-oxoethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[2-(4-cyano-3-ethylpyrido[1,2-a]benzimidazol-1-yl)sulfanylacetyl]amino]acetate Traditional Name: 2-[[2-[(4-cyano-3-ethyl-pyrido[1,2-a]benzimidazol-1-yl)thio]acetyl]amino]acetic acid methyl ester Formula: C19H18N4O3S MolecularWeight: 382.43622

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC(=O)NCC(=O)OC)C#N

Isomeric SMILES

CCC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC(=O)NCC(=O)OC)C#N

InChI

InChI=1S/C19H18N4O3S/c1-3-12-8-17(27-11-16(24)21-10-18(25)26-2)23-15-7-5-4-6-14(15)22-19(23)13(12)9-20/h4-8H,3,10-11H2,1-2H3,(H,21,24)