4-(1,3-benzodioxol-5-yl)-N-(3-chlorophenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-N-(3-chlorophenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Openeye Name: 4-(1,3-benzodioxol-5-yl)-N-(3-chlorophenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide CAS Name: 4-(1,3-benzodioxol-5-yl)-N-(3-chlorophenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide IUPAC Name: 4-(1,3-benzodioxol-5-yl)-N-(3-chlorophenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Traditional Name: 4-(1,3-benzodioxol-5-yl)-N-(3-chlorophenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide Formula: C19H16ClN3O3S MolecularWeight: 401.86664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)C2=CC3=C(C=C2)OCO3)C(=O)NC4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=C(C(NC(=S)N1)C2=CC3=C(C=C2)OCO3)C(=O)NC4=CC(=CC=C4)Cl

InChI

InChI=1S/C19H16ClN3O3S/c1-10-16(18(24)22-13-4-2-3-12(20)8-13)17(23-19(27)21-10)11-5-6-14-15(7-11)26-9-25-14/h2-8,17H,9H2,1H3,(H,22,24)(H2,21,23,27)