2-[5-azanyl-4-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-oxidanylidene-2H-pyrrol-1-yl]benzamide

Systemtic Name: 2-[5-azanyl-4-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-oxidanylidene-2H-pyrrol-1-yl]benzamide Openeye Name: 2-[5-amino-4-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-3-oxo-2H-pyrrol-1-yl]benzamide CAS Name: 2-[5-amino-4-[4-(3,4-dimethoxyphenyl)-2-thiazolyl]-3-oxo-2H-pyrrol-1-yl]benzamide IUPAC Name: 2-[5-amino-4-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-oxo-2H-pyrrol-1-yl]benzamide Traditional Name: 2-[2-amino-3-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-4-keto-2-pyrrolin-1-yl]benzamide Formula: C22H20N4O4S MolecularWeight: 436.4836

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=N2)C3=C(N(CC3=O)C4=CC=CC=C4C(=O)N)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=N2)C3=C(N(CC3=O)C4=CC=CC=C4C(=O)N)N)OC

InChI

InChI=1S/C22H20N4O4S/c1-29-17-8-7-12(9-18(17)30-2)14-11-31-22(25-14)19-16(27)10-26(20(19)23)15-6-4-3-5-13(15)21(24)28/h3-9,11H,10,23H2,1-2H3,(H2,24,28)