(4S)-4-(3-iodanyl-4-oxidanyl-phenyl)-N-(2-methoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide

Systemtic Name: (4S)-4-(3-iodanyl-4-oxidanyl-phenyl)-N-(2-methoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Openeye Name: (4S)-4-(4-hydroxy-3-iodo-phenyl)-N-(2-methoxyphenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide CAS Name: (4S)-4-(4-hydroxy-3-iodophenyl)-N-(2-methoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide IUPAC Name: (4S)-4-(4-hydroxy-3-iodophenyl)-N-(2-methoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Traditional Name: (4S)-4-(4-hydroxy-3-iodo-phenyl)-N-(2-methoxyphenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide Formula: C19H18IN3O3S MolecularWeight: 495.33399

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)C2=CC(=C(C=C2)O)I)C(=O)NC3=CC=CC=C3OC

Isomeric SMILES

CC1=C([C@@H](NC(=S)N1)C2=CC(=C(C=C2)O)I)C(=O)NC3=CC=CC=C3OC

InChI

InChI=1S/C19H18IN3O3S/c1-10-16(18(25)22-13-5-3-4-6-15(13)26-2)17(23-19(27)21-10)11-7-8-14(24)12(20)9-11/h3-9,17,24H,1-2H3,(H,22,25)(H2,21,23,27)/t17-/m0/s1