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

Systemtic Name: 4-[2-[4-(1H-benzimidazol-2-yl)butanoylamino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxamide Openeye Name: 4-[2-[4-(1H-benzimidazol-2-yl)butanoylamino]thiazol-4-yl]-1H-pyrrole-2-carboxamide CAS Name: 4-[2-[[4-(1H-benzimidazol-2-yl)-1-oxobutyl]amino]-4-thiazolyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-[2-[4-(1H-benzimidazol-2-yl)butanoylamino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxamide Traditional Name: 4-[2-[4-(1H-benzimidazol-2-yl)butanoylamino]thiazol-4-yl]-1H-pyrrole-2-carboxamide Formula: C19H18N6O2S MolecularWeight: 394.45022

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)CCCC(=O)NC3=NC(=CS3)C4=CNC(=C4)C(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)CCCC(=O)NC3=NC(=CS3)C4=CNC(=C4)C(=O)N

InChI

InChI=1S/C19H18N6O2S/c20-18(27)14-8-11(9-21-14)15-10-28-19(24-15)25-17(26)7-3-6-16-22-12-4-1-2-5-13(12)23-16/h1-2,4-5,8-10,21H,3,6-7H2,(H2,20,27)(H,22,23)(H,24,25,26)