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

Systemtic Name: 4-[5-azanyl-4-(1,3-benzothiazol-2-yl)-3-oxidanylidene-2H-pyrrol-1-yl]-N-methyl-N-(phenylmethyl)benzamide Openeye Name: 4-[5-amino-4-(1,3-benzothiazol-2-yl)-3-oxo-2H-pyrrol-1-yl]-N-benzyl-N-methyl-benzamide CAS Name: 4-[5-amino-4-(1,3-benzothiazol-2-yl)-3-oxo-2H-pyrrol-1-yl]-N-methyl-N-(phenylmethyl)benzamide IUPAC Name: 4-[5-amino-4-(1,3-benzothiazol-2-yl)-3-oxo-2H-pyrrol-1-yl]-N-benzyl-N-methylbenzamide Traditional Name: 4-[2-amino-3-(1,3-benzothiazol-2-yl)-4-keto-2-pyrrolin-1-yl]-N-benzyl-N-methyl-benzamide Formula: C26H22N4O2S MolecularWeight: 454.54348

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=O)C2=CC=C(C=C2)N3CC(=O)C(=C3N)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=O)C2=CC=C(C=C2)N3CC(=O)C(=C3N)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C26H22N4O2S/c1-29(15-17-7-3-2-4-8-17)26(32)18-11-13-19(14-12-18)30-16-21(31)23(24(30)27)25-28-20-9-5-6-10-22(20)33-25/h2-14H,15-16,27H2,1H3