methyl 2-[2-[(3Z)-3-cyano-3-(3-methyl-1H-benzimidazol-2-ylidene)-2-oxidanylidene-propyl]sulfanyl-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate

Systemtic Name: methyl 2-[2-[(3Z)-3-cyano-3-(3-methyl-1H-benzimidazol-2-ylidene)-2-oxidanylidene-propyl]sulfanyl-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate Openeye Name: methyl 2-[2-[(3Z)-3-cyano-3-(3-methyl-1H-benzimidazol-2-ylidene)-2-oxo-propyl]sulfanyl-4-oxo-1H-pyrimidin-6-yl]acetate CAS Name: 2-[2-[[(3Z)-3-cyano-3-(3-methyl-1H-benzimidazol-2-ylidene)-2-oxopropyl]thio]-4-oxo-1H-pyrimidin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[(3Z)-3-cyano-3-(3-methyl-1H-benzimidazol-2-ylidene)-2-oxopropyl]sulfanyl-4-oxo-1H-pyrimidin-6-yl]acetate Traditional Name: 2-[2-[[(3Z)-3-cyano-2-keto-3-(3-methyl-1H-benzimidazol-2-ylidene)propyl]thio]-4-keto-1H-pyrimidin-6-yl]acetic acid methyl ester Formula: C19H17N5O4S MolecularWeight: 411.43438

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2NC1=C(C#N)C(=O)CSC3=NC(=O)C=C(N3)CC(=O)OC

Isomeric SMILES

CN\1C2=CC=CC=C2N/C1=C(\C#N)/C(=O)CSC3=NC(=O)C=C(N3)CC(=O)OC

InChI

InChI=1S/C19H17N5O4S/c1-24-14-6-4-3-5-13(14)22-18(24)12(9-20)15(25)10-29-19-21-11(7-16(26)23-19)8-17(27)28-2/h3-7,22H,8,10H2,1-2H3,(H,21,23,26)/b18-12-