methyl 2-[2-[(4-methylpyrimidin-2-yl)sulfanylmethyl]-4-oxidanylidene-pyrimido[1,2-a]benzimidazol-1-yl]ethanoate

Systemtic Name: methyl 2-[2-[(4-methylpyrimidin-2-yl)sulfanylmethyl]-4-oxidanylidene-pyrimido[1,2-a]benzimidazol-1-yl]ethanoate Openeye Name: methyl 2-[2-[(4-methylpyrimidin-2-yl)sulfanylmethyl]-4-oxo-pyrimido[1,2-a]benzimidazol-1-yl]acetate CAS Name: 2-[2-[[(4-methyl-2-pyrimidinyl)thio]methyl]-4-oxo-1-pyrimido[1,2-a]benzimidazolyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[(4-methylpyrimidin-2-yl)sulfanylmethyl]-4-oxopyrimido[1,2-a]benzimidazol-1-yl]acetate Traditional Name: 2-[4-keto-2-[[(4-methylpyrimidin-2-yl)thio]methyl]pyrimido[1,2-a]benzimidazol-1-yl]acetic acid methyl ester Formula: C19H17N5O3S MolecularWeight: 395.43498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)SCC2=CC(=O)N3C4=CC=CC=C4N=C3N2CC(=O)OC

Isomeric SMILES

CC1=NC(=NC=C1)SCC2=CC(=O)N3C4=CC=CC=C4N=C3N2CC(=O)OC

InChI

InChI=1S/C19H17N5O3S/c1-12-7-8-20-18(21-12)28-11-13-9-16(25)24-15-6-4-3-5-14(15)22-19(24)23(13)10-17(26)27-2/h3-9H,10-11H2,1-2H3