3-[[4-(4-cyclohexylphenyl)-1,3-thiazol-2-yl]amino]-6,7-dimethoxy-3H-2-benzofuran-1-one

Systemtic Name: 3-[[4-(4-cyclohexylphenyl)-1,3-thiazol-2-yl]amino]-6,7-dimethoxy-3H-2-benzofuran-1-one Openeye Name: 3-[[4-(4-cyclohexylphenyl)thiazol-2-yl]amino]-6,7-dimethoxy-3H-isobenzofuran-1-one CAS Name: 3-[[4-(4-cyclohexylphenyl)-2-thiazolyl]amino]-6,7-dimethoxy-3H-isobenzofuran-1-one IUPAC Name: 3-[[4-(4-cyclohexylphenyl)-1,3-thiazol-2-yl]amino]-6,7-dimethoxy-3H-2-benzofuran-1-one Traditional Name: 3-[[4-(4-cyclohexylphenyl)thiazol-2-yl]amino]-6,7-dimethoxy-phthalide Formula: C25H26N2O4S MolecularWeight: 450.54994

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(OC2=O)NC3=NC(=CS3)C4=CC=C(C=C4)C5CCCCC5)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)C(OC2=O)NC3=NC(=CS3)C4=CC=C(C=C4)C5CCCCC5)OC

InChI

InChI=1S/C25H26N2O4S/c1-29-20-13-12-18-21(22(20)30-2)24(28)31-23(18)27-25-26-19(14-32-25)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h8-15,23H,3-7H2,1-2H3,(H,26,27)