2-(1,3-benzodioxol-5-yl)-4-sulfanyloxy-3,5-dihydro-2H-chromeno[2,3-d]pyrimidine

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-4-sulfanyloxy-3,5-dihydro-2H-chromeno[2,3-d]pyrimidine Openeye Name: 2-(1,3-benzodioxol-5-yl)-4-sulfanyloxy-3,5-dihydro-2H-chromeno[2,3-d]pyrimidine CAS Name: 2-(1,3-benzodioxol-5-yl)-4-mercaptooxy-3,5-dihydro-2H-[1]benzopyrano[2,3-d]pyrimidine IUPAC Name: 2-(1,3-benzodioxol-5-yl)-4-sulfanyloxy-3,5-dihydro-2H-chromeno[2,3-d]pyrimidine Traditional Name: 2-(1,3-benzodioxol-5-yl)-4-mercaptooxy-3,5-dihydro-2H-chromeno[2,3-d]pyrimidine Formula: C18H14N2O4S MolecularWeight: 354.37976

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2OC3=NC(NC(=C31)OS)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1C2=CC=CC=C2OC3=NC(NC(=C31)OS)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C18H14N2O4S/c25-24-18-12-7-10-3-1-2-4-13(10)23-17(12)19-16(20-18)11-5-6-14-15(8-11)22-9-21-14/h1-6,8,16,20,25H,7,9H2