4-(1,3-benzothiazol-2-ylsulfanylmethyl)-6-methoxy-chromen-2-one

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-6-methoxy-chromen-2-one Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-6-methoxy-chromen-2-one CAS Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-6-methoxy-1-benzopyran-2-one IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-6-methoxychromen-2-one Traditional Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-6-methoxy-coumarin Formula: C18H13NO3S2 MolecularWeight: 355.43072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OC(=O)C=C2CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC2=C(C=C1)OC(=O)C=C2CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H13NO3S2/c1-21-12-6-7-15-13(9-12)11(8-17(20)22-15)10-23-18-19-14-4-2-3-5-16(14)24-18/h2-9H,10H2,1H3