methyl 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-4-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-butanoate

Systemtic Name: methyl 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-4-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-butanoate Openeye Name: methyl 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-4-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-butanoate CAS Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-4-[(4,5,6-trimethyl-2-pyrimidinyl)thio]butanoic acid methyl ester IUPAC Name: methyl 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-4-(4,5,6-trimethylpyrimidin-2-yl)sulfanylbutanoate Traditional Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-keto-4-[(4,5,6-trimethylpyrimidin-2-yl)thio]butyric acid methyl ester Formula: C19H20N4O3S MolecularWeight: 384.4521

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1C)SCC(=O)C(=C2NC3=CC=CC=C3N2)C(=O)OC)C

Isomeric SMILES

CC1=C(N=C(N=C1C)SCC(=O)C(=C2NC3=CC=CC=C3N2)C(=O)OC)C

InChI

InChI=1S/C19H20N4O3S/c1-10-11(2)20-19(21-12(10)3)27-9-15(24)16(18(25)26-4)17-22-13-7-5-6-8-14(13)23-17/h5-8,22-23H,9H2,1-4H3