N-[6-azanyl-2-[(3,4-dichlorophenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-5-yl]-4-methyl-benzamide

Systemtic Name: N-[6-azanyl-2-[(3,4-dichlorophenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-5-yl]-4-methyl-benzamide Openeye Name: N-[6-amino-2-[(3,4-dichlorophenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-5-yl]-4-methyl-benzamide CAS Name: N-[6-amino-2-[(3,4-dichlorophenyl)methylthio]-4-oxo-1H-pyrimidin-5-yl]-4-methylbenzamide IUPAC Name: N-[6-amino-2-[(3,4-dichlorophenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-5-yl]-4-methylbenzamide Traditional Name: N-[6-amino-2-[(3,4-dichlorobenzyl)thio]-4-keto-1H-pyrimidin-5-yl]-4-methyl-benzamide Formula: C19H16Cl2N4O2S MolecularWeight: 435.32694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=C(NC(=NC2=O)SCC3=CC(=C(C=C3)Cl)Cl)N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=C(NC(=NC2=O)SCC3=CC(=C(C=C3)Cl)Cl)N

InChI

InChI=1S/C19H16Cl2N4O2S/c1-10-2-5-12(6-3-10)17(26)23-15-16(22)24-19(25-18(15)27)28-9-11-4-7-13(20)14(21)8-11/h2-8H,9H2,1H3,(H,23,26)(H3,22,24,25,27)