4-(5-bromanyl-2-oxidanyl-phenyl)-N-(4-chlorophenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide

Systemtic Name: 4-(5-bromanyl-2-oxidanyl-phenyl)-N-(4-chlorophenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Openeye Name: 4-(5-bromo-2-hydroxy-phenyl)-N-(4-chlorophenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide CAS Name: 4-(5-bromo-2-hydroxyphenyl)-N-(4-chlorophenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide IUPAC Name: 4-(5-bromo-2-hydroxyphenyl)-N-(4-chlorophenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Traditional Name: 4-(5-bromo-2-hydroxy-phenyl)-N-(4-chlorophenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide Formula: C18H15BrClN3O2S MolecularWeight: 452.7526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)C2=C(C=CC(=C2)Br)O)C(=O)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C(NC(=S)N1)C2=C(C=CC(=C2)Br)O)C(=O)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H15BrClN3O2S/c1-9-15(17(25)22-12-5-3-11(20)4-6-12)16(23-18(26)21-9)13-8-10(19)2-7-14(13)24/h2-8,16,24H,1H3,(H,22,25)(H2,21,23,26)