6-(3-chlorophenyl)-2-phenyl-4-sulfanylidene-1H-pyrimidine-5-carbonitrile

Systemtic Name: 6-(3-chlorophenyl)-2-phenyl-4-sulfanylidene-1H-pyrimidine-5-carbonitrile Openeye Name: 6-(3-chlorophenyl)-2-phenyl-4-thioxo-1H-pyrimidine-5-carbonitrile CAS Name: 6-(3-chlorophenyl)-2-phenyl-4-sulfanylidene-1H-pyrimidine-5-carbonitrile IUPAC Name: 6-(3-chlorophenyl)-2-phenyl-4-sulfanylidene-1H-pyrimidine-5-carbonitrile Traditional Name: 6-(3-chlorophenyl)-2-phenyl-4-thioxo-1H-pyrimidine-5-carbonitrile Formula: C17H10ClN3S MolecularWeight: 323.7994

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=S)C(=C(N2)C3=CC(=CC=C3)Cl)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=S)C(=C(N2)C3=CC(=CC=C3)Cl)C#N

InChI

InChI=1S/C17H10ClN3S/c18-13-8-4-7-12(9-13)15-14(10-19)17(22)21-16(20-15)11-5-2-1-3-6-11/h1-9H,(H,20,21,22)