2-(1,3-benzothiazol-2-ylsulfanylmethyl)-6,7-dimethoxy-1H-quinazolin-4-one

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanylmethyl)-6,7-dimethoxy-1H-quinazolin-4-one Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanylmethyl)-6,7-dimethoxy-1H-quinazolin-4-one CAS Name: 2-[(1,3-benzothiazol-2-ylthio)methyl]-6,7-dimethoxy-1H-quinazolin-4-one IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanylmethyl)-6,7-dimethoxy-1H-quinazolin-4-one Traditional Name: 2-[(1,3-benzothiazol-2-ylthio)methyl]-6,7-dimethoxy-1H-quinazolin-4-one Formula: C18H15N3O3S2 MolecularWeight: 385.46

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)N=C(N2)CSC3=NC4=CC=CC=C4S3)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)N=C(N2)CSC3=NC4=CC=CC=C4S3)OC

InChI

InChI=1S/C18H15N3O3S2/c1-23-13-7-10-12(8-14(13)24-2)19-16(21-17(10)22)9-25-18-20-11-5-3-4-6-15(11)26-18/h3-8H,9H2,1-2H3,(H,19,21,22)