2-[2-[(3-acetamidophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1-methyl-6-oxidanylidene-N-phenyl-pyrimidine-5-carboxamide

Systemtic Name: 2-[2-[(3-acetamidophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1-methyl-6-oxidanylidene-N-phenyl-pyrimidine-5-carboxamide Openeye Name: 2-[2-(3-acetamidoanilino)-2-oxo-ethyl]sulfanyl-1-methyl-6-oxo-N-phenyl-pyrimidine-5-carboxamide CAS Name: 2-[[2-(3-acetamidoanilino)-2-oxoethyl]thio]-1-methyl-6-oxo-N-phenyl-5-pyrimidinecarboxamide IUPAC Name: 2-[2-(3-acetamidoanilino)-2-oxoethyl]sulfanyl-1-methyl-6-oxo-N-phenylpyrimidine-5-carboxamide Traditional Name: 2-[[2-(3-acetamidoanilino)-2-keto-ethyl]thio]-6-keto-1-methyl-N-phenyl-pyrimidine-5-carboxamide Formula: C22H21N5O4S MolecularWeight: 451.49824

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC=C1)NC(=O)CSC2=NC=C(C(=O)N2C)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CC(=O)NC1=CC(=CC=C1)NC(=O)CSC2=NC=C(C(=O)N2C)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H21N5O4S/c1-14(28)24-16-9-6-10-17(11-16)25-19(29)13-32-22-23-12-18(21(31)27(22)2)20(30)26-15-7-4-3-5-8-15/h3-12H,13H2,1-2H3,(H,24,28)(H,25,29)(H,26,30)