4-[4-(1,3-benzodioxol-5-ylmethylideneamino)phenyl]-6-(3-chlorophenyl)-5,6-dihydro-1H-pyrimidine-2-thione

Systemtic Name: 4-[4-(1,3-benzodioxol-5-ylmethylideneamino)phenyl]-6-(3-chlorophenyl)-5,6-dihydro-1H-pyrimidine-2-thione Openeye Name: 4-[4-(1,3-benzodioxol-5-ylmethyleneamino)phenyl]-6-(3-chlorophenyl)-5,6-dihydro-1H-pyrimidine-2-thione CAS Name: 4-[4-(1,3-benzodioxol-5-ylmethylideneamino)phenyl]-6-(3-chlorophenyl)-5,6-dihydro-1H-pyrimidine-2-thione IUPAC Name: 4-[4-(1,3-benzodioxol-5-ylmethylideneamino)phenyl]-6-(3-chlorophenyl)-5,6-dihydro-1H-pyrimidine-2-thione Traditional Name: 6-(3-chlorophenyl)-4-[4-(piperonylideneamino)phenyl]-5,6-dihydro-1H-pyrimidine-2-thione Formula: C24H18ClN3O2S MolecularWeight: 447.93662

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC(=S)N=C1C2=CC=C(C=C2)N=CC3=CC4=C(C=C3)OCO4)C5=CC(=CC=C5)Cl

Isomeric SMILES

C1C(NC(=S)N=C1C2=CC=C(C=C2)N=CC3=CC4=C(C=C3)OCO4)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C24H18ClN3O2S/c25-18-3-1-2-17(11-18)21-12-20(27-24(31)28-21)16-5-7-19(8-6-16)26-13-15-4-9-22-23(10-15)30-14-29-22/h1-11,13,21H,12,14H2,(H,28,31)