(2S)-3-(4-chlorophenyl)-2-(furan-2-yl)-6-oxidanylidene-4-sulfanyl-1,2-dihydropyrimidine-5-carbonitrile

Systemtic Name: (2S)-3-(4-chlorophenyl)-2-(furan-2-yl)-6-oxidanylidene-4-sulfanyl-1,2-dihydropyrimidine-5-carbonitrile Openeye Name: (2S)-3-(4-chlorophenyl)-2-(2-furyl)-6-oxo-4-sulfanyl-1,2-dihydropyrimidine-5-carbonitrile CAS Name: (2S)-3-(4-chlorophenyl)-2-(2-furanyl)-4-mercapto-6-oxo-1,2-dihydropyrimidine-5-carbonitrile IUPAC Name: (2S)-3-(4-chlorophenyl)-2-(furan-2-yl)-6-oxo-4-sulfanyl-1,2-dihydropyrimidine-5-carbonitrile Traditional Name: (2S)-3-(4-chlorophenyl)-2-(2-furyl)-6-keto-4-mercapto-1,2-dihydropyrimidine-5-carbonitrile Formula: C15H10ClN3O2S MolecularWeight: 331.7768

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C2NC(=O)C(=C(N2C3=CC=C(C=C3)Cl)S)C#N

Isomeric SMILES

C1=COC(=C1)[C@H]2NC(=O)C(=C(N2C3=CC=C(C=C3)Cl)S)C#N

InChI

InChI=1S/C15H10ClN3O2S/c16-9-3-5-10(6-4-9)19-13(12-2-1-7-21-12)18-14(20)11(8-17)15(19)22/h1-7,13,22H,(H,18,20)/t13-/m0/s1