4-[[[3-(1,3-benzothiazol-2-yl)phenyl]amino]methyl]-7-oxidanyl-chromen-2-one

Systemtic Name: 4-[[[3-(1,3-benzothiazol-2-yl)phenyl]amino]methyl]-7-oxidanyl-chromen-2-one Openeye Name: 4-[[3-(1,3-benzothiazol-2-yl)anilino]methyl]-7-hydroxy-chromen-2-one CAS Name: 4-[[3-(1,3-benzothiazol-2-yl)anilino]methyl]-7-hydroxy-1-benzopyran-2-one IUPAC Name: 4-[[3-(1,3-benzothiazol-2-yl)anilino]methyl]-7-hydroxychromen-2-one Traditional Name: 4-[[3-(1,3-benzothiazol-2-yl)anilino]methyl]-7-hydroxy-coumarin Formula: C23H16N2O3S MolecularWeight: 400.44974

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CC(=CC=C3)NCC4=CC(=O)OC5=C4C=CC(=C5)O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CC(=CC=C3)NCC4=CC(=O)OC5=C4C=CC(=C5)O

InChI

InChI=1S/C23H16N2O3S/c26-17-8-9-18-15(11-22(27)28-20(18)12-17)13-24-16-5-3-4-14(10-16)23-25-19-6-1-2-7-21(19)29-23/h1-12,24,26H,13H2