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

Systemtic Name: 4-[2-[2-(benzimidazol-1-yl)propanoylamino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxamide Openeye Name: 4-[2-[2-(benzimidazol-1-yl)propanoylamino]thiazol-4-yl]-1H-pyrrole-2-carboxamide CAS Name: 4-[2-[[2-(1-benzimidazolyl)-1-oxopropyl]amino]-4-thiazolyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-[2-[2-(benzimidazol-1-yl)propanoylamino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxamide Traditional Name: 4-[2-[2-(benzimidazol-1-yl)propanoylamino]thiazol-4-yl]-1H-pyrrole-2-carboxamide Formula: C18H16N6O2S MolecularWeight: 380.42364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC(=CS1)C2=CNC(=C2)C(=O)N)N3C=NC4=CC=CC=C43

Isomeric SMILES

CC(C(=O)NC1=NC(=CS1)C2=CNC(=C2)C(=O)N)N3C=NC4=CC=CC=C43

InChI

InChI=1S/C18H16N6O2S/c1-10(24-9-21-12-4-2-3-5-15(12)24)17(26)23-18-22-14(8-27-18)11-6-13(16(19)25)20-7-11/h2-10,20H,1H3,(H2,19,25)(H,22,23,26)