2-azanyl-3-(1,3-benzodioxol-5-yl)thiochromen-4-one

Systemtic Name: 2-azanyl-3-(1,3-benzodioxol-5-yl)thiochromen-4-one Openeye Name: 2-amino-3-(1,3-benzodioxol-5-yl)thiochromen-4-one CAS Name: 2-amino-3-(1,3-benzodioxol-5-yl)-1-benzothiopyran-4-one IUPAC Name: 2-amino-3-(1,3-benzodioxol-5-yl)thiochromen-4-one Traditional Name: 2-amino-3-(1,3-benzodioxol-5-yl)thiochromen-4-one Formula: C16H11NO3S MolecularWeight: 297.32844

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=C(SC4=CC=CC=C4C3=O)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=C(SC4=CC=CC=C4C3=O)N

InChI

InChI=1S/C16H11NO3S/c17-16-14(9-5-6-11-12(7-9)20-8-19-11)15(18)10-3-1-2-4-13(10)21-16/h1-7H,8,17H2