4-[5-azanyl-4-(1,3-benzothiazol-2-yl)-3-oxidanylidene-2H-pyrrol-1-yl]-N-[(2-methoxyphenyl)methyl]benzamide

Systemtic Name: 4-[5-azanyl-4-(1,3-benzothiazol-2-yl)-3-oxidanylidene-2H-pyrrol-1-yl]-N-[(2-methoxyphenyl)methyl]benzamide Openeye Name: 4-[5-amino-4-(1,3-benzothiazol-2-yl)-3-oxo-2H-pyrrol-1-yl]-N-[(2-methoxyphenyl)methyl]benzamide CAS Name: 4-[5-amino-4-(1,3-benzothiazol-2-yl)-3-oxo-2H-pyrrol-1-yl]-N-[(2-methoxyphenyl)methyl]benzamide IUPAC Name: 4-[5-amino-4-(1,3-benzothiazol-2-yl)-3-oxo-2H-pyrrol-1-yl]-N-[(2-methoxyphenyl)methyl]benzamide Traditional Name: 4-[2-amino-3-(1,3-benzothiazol-2-yl)-4-keto-2-pyrrolin-1-yl]-N-o-anisyl-benzamide Formula: C26H22N4O3S MolecularWeight: 470.54288

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CNC(=O)C2=CC=C(C=C2)N3CC(=O)C(=C3N)C4=NC5=CC=CC=C5S4

Isomeric SMILES

COC1=CC=CC=C1CNC(=O)C2=CC=C(C=C2)N3CC(=O)C(=C3N)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C26H22N4O3S/c1-33-21-8-4-2-6-17(21)14-28-25(32)16-10-12-18(13-11-16)30-15-20(31)23(24(30)27)26-29-19-7-3-5-9-22(19)34-26/h2-13H,14-15,27H2,1H3,(H,28,32)