2-azanyl-5-[5-bromanyl-1-[(3,4-dimethoxyphenyl)methyl]-3-oxidanyl-2-oxidanylidene-indol-3-yl]-1,3-thiazol-4-one

Systemtic Name: 2-azanyl-5-[5-bromanyl-1-[(3,4-dimethoxyphenyl)methyl]-3-oxidanyl-2-oxidanylidene-indol-3-yl]-1,3-thiazol-4-one Openeye Name: 2-amino-5-[5-bromo-1-[(3,4-dimethoxyphenyl)methyl]-3-hydroxy-2-oxo-indolin-3-yl]thiazol-4-one CAS Name: 2-amino-5-[5-bromo-1-[(3,4-dimethoxyphenyl)methyl]-3-hydroxy-2-oxo-3-indolyl]-4-thiazolone IUPAC Name: 2-amino-5-[5-bromo-1-[(3,4-dimethoxyphenyl)methyl]-3-hydroxy-2-oxoindol-3-yl]-1,3-thiazol-4-one Traditional Name: 2-amino-5-(5-bromo-3-hydroxy-2-keto-1-veratryl-indolin-3-yl)-2-thiazolin-4-one Formula: C20H18BrN3O5S MolecularWeight: 492.34302

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2C3=C(C=C(C=C3)Br)C(C2=O)(C4C(=O)N=C(S4)N)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN2C3=C(C=C(C=C3)Br)C(C2=O)(C4C(=O)N=C(S4)N)O)OC

InChI

InChI=1S/C20H18BrN3O5S/c1-28-14-6-3-10(7-15(14)29-2)9-24-13-5-4-11(21)8-12(13)20(27,18(24)26)16-17(25)23-19(22)30-16/h3-8,16,27H,9H2,1-2H3,(H2,22,23,25)