1-[6-[(2-chlorophenyl)amino]-2-phenyl-4-sulfanylidene-1H-pyrimidin-5-yl]ethanone

Systemtic Name: 1-[6-[(2-chlorophenyl)amino]-2-phenyl-4-sulfanylidene-1H-pyrimidin-5-yl]ethanone Openeye Name: 1-[6-(2-chloroanilino)-2-phenyl-4-thioxo-1H-pyrimidin-5-yl]ethanone CAS Name: 1-[6-(2-chloroanilino)-2-phenyl-4-sulfanylidene-1H-pyrimidin-5-yl]ethanone IUPAC Name: 1-[6-(2-chloroanilino)-2-phenyl-4-sulfanylidene-1H-pyrimidin-5-yl]ethanone Traditional Name: 1-[6-(2-chloroanilino)-2-phenyl-4-thioxo-1H-pyrimidin-5-yl]ethanone Formula: C18H14ClN3OS MolecularWeight: 355.84126

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(NC(=NC1=S)C2=CC=CC=C2)NC3=CC=CC=C3Cl

Isomeric SMILES

CC(=O)C1=C(NC(=NC1=S)C2=CC=CC=C2)NC3=CC=CC=C3Cl

InChI

InChI=1S/C18H14ClN3OS/c1-11(23)15-17(20-14-10-6-5-9-13(14)19)21-16(22-18(15)24)12-7-3-2-4-8-12/h2-10H,1H3,(H2,20,21,22,24)