4-[2-(3-benzamidobutanoylamino)-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxamide

Systemtic Name: 4-[2-(3-benzamidobutanoylamino)-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxamide Openeye Name: 4-[2-(3-benzamidobutanoylamino)thiazol-4-yl]-1H-pyrrole-2-carboxamide CAS Name: 4-[2-[(3-benzamido-1-oxobutyl)amino]-4-thiazolyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-[2-(3-benzamidobutanoylamino)-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxamide Traditional Name: 4-[2-(3-benzamidobutanoylamino)thiazol-4-yl]-1H-pyrrole-2-carboxamide Formula: C19H19N5O3S MolecularWeight: 397.45086

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC1=NC(=CS1)C2=CNC(=C2)C(=O)N)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(CC(=O)NC1=NC(=CS1)C2=CNC(=C2)C(=O)N)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H19N5O3S/c1-11(22-18(27)12-5-3-2-4-6-12)7-16(25)24-19-23-15(10-28-19)13-8-14(17(20)26)21-9-13/h2-6,8-11,21H,7H2,1H3,(H2,20,26)(H,22,27)(H,23,24,25)