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

Systemtic Name: 4-[2-(3-benzamidopropanoylamino)-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxamide Openeye Name: 4-[2-(3-benzamidopropanoylamino)thiazol-4-yl]-1H-pyrrole-2-carboxamide CAS Name: 4-[2-[(3-benzamido-1-oxopropyl)amino]-4-thiazolyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-[2-(3-benzamidopropanoylamino)-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxamide Traditional Name: 4-[2-(3-benzamidopropanoylamino)thiazol-4-yl]-1H-pyrrole-2-carboxamide Formula: C18H17N5O3S MolecularWeight: 383.42428

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NCCC(=O)NC2=NC(=CS2)C3=CNC(=C3)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NCCC(=O)NC2=NC(=CS2)C3=CNC(=C3)C(=O)N

InChI

InChI=1S/C18H17N5O3S/c19-16(25)13-8-12(9-21-13)14-10-27-18(22-14)23-15(24)6-7-20-17(26)11-4-2-1-3-5-11/h1-5,8-10,21H,6-7H2,(H2,19,25)(H,20,26)(H,22,23,24)