4-(1,3-benzodioxol-5-yl)-6-(4-bromophenyl)-3,4-dihydro-1H-pyrimidine-2-thione

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-6-(4-bromophenyl)-3,4-dihydro-1H-pyrimidine-2-thione Openeye Name: 4-(1,3-benzodioxol-5-yl)-6-(4-bromophenyl)-3,4-dihydro-1H-pyrimidine-2-thione CAS Name: 4-(1,3-benzodioxol-5-yl)-6-(4-bromophenyl)-3,4-dihydro-1H-pyrimidine-2-thione IUPAC Name: 4-(1,3-benzodioxol-5-yl)-6-(4-bromophenyl)-3,4-dihydro-1H-pyrimidine-2-thione Traditional Name: 4-(1,3-benzodioxol-5-yl)-6-(4-bromophenyl)-3,4-dihydro-1H-pyrimidine-2-thione Formula: C17H13BrN2O2S MolecularWeight: 389.26632

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3C=C(NC(=S)N3)C4=CC=C(C=C4)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3C=C(NC(=S)N3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C17H13BrN2O2S/c18-12-4-1-10(2-5-12)13-8-14(20-17(23)19-13)11-3-6-15-16(7-11)22-9-21-15/h1-8,14H,9H2,(H2,19,20,23)