2-(1,3-benzoxazol-2-ylsulfanyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone CAS Name: 2-(1,3-benzoxazol-2-ylthio)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone Traditional Name: 2-(1,3-benzoxazol-2-ylthio)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone Formula: C34H26N2O8S2 MolecularWeight: 654.70884

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C(=O)CSC3=NC4=CC=CC=C4O3.C1COC2=C(O1)C=CC(=C2)C(=O)CSC3=NC4=CC=CC=C4O3

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C(=O)CSC3=NC4=CC=CC=C4O3.C1COC2=C(O1)C=CC(=C2)C(=O)CSC3=NC4=CC=CC=C4O3

InChI

InChI=1S/2C17H13NO4S/c2*19-13(11-5-6-15-16(9-11)21-8-7-20-15)10-23-17-18-12-3-1-2-4-14(12)22-17/h2*1-6,9H,7-8,10H2