4-[2-[(3-acetamido-3-thiophen-2-yl-propanoyl)amino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxamide

Systemtic Name: 4-[2-[(3-acetamido-3-thiophen-2-yl-propanoyl)amino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxamide Openeye Name: 4-[2-[[3-acetamido-3-(2-thienyl)propanoyl]amino]thiazol-4-yl]-1H-pyrrole-2-carboxamide CAS Name: 4-[2-[(3-acetamido-1-oxo-3-thiophen-2-ylpropyl)amino]-4-thiazolyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-[2-[(3-acetamido-3-thiophen-2-ylpropanoyl)amino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxamide Traditional Name: 4-[2-[[3-acetamido-3-(2-thienyl)propanoyl]amino]thiazol-4-yl]-1H-pyrrole-2-carboxamide Formula: C17H17N5O3S2 MolecularWeight: 403.47858

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC(=O)NC1=NC(=CS1)C2=CNC(=C2)C(=O)N)C3=CC=CS3

Isomeric SMILES

CC(=O)NC(CC(=O)NC1=NC(=CS1)C2=CNC(=C2)C(=O)N)C3=CC=CS3

InChI

InChI=1S/C17H17N5O3S2/c1-9(23)20-11(14-3-2-4-26-14)6-15(24)22-17-21-13(8-27-17)10-5-12(16(18)25)19-7-10/h2-5,7-8,11,19H,6H2,1H3,(H2,18,25)(H,20,23)(H,21,22,24)