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

Systemtic Name: N-[4-[4-(butanoylamino)phenyl]-1,3-thiazol-2-yl]-4-ethanoyl-1H-pyrrole-2-carboxamide Openeye Name: 4-acetyl-N-[4-[4-(butanoylamino)phenyl]thiazol-2-yl]-1H-pyrrole-2-carboxamide CAS Name: 4-acetyl-N-[4-[4-(1-oxobutylamino)phenyl]-2-thiazolyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-acetyl-N-[4-[4-(butanoylamino)phenyl]-1,3-thiazol-2-yl]-1H-pyrrole-2-carboxamide Traditional Name: 4-acetyl-N-[4-(4-butyramidophenyl)thiazol-2-yl]-1H-pyrrole-2-carboxamide Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC(=CN3)C(=O)C

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC(=CN3)C(=O)C

InChI

InChI=1S/C20H20N4O3S/c1-3-4-18(26)22-15-7-5-13(6-8-15)17-11-28-20(23-17)24-19(27)16-9-14(10-21-16)12(2)25/h5-11,21H,3-4H2,1-2H3,(H,22,26)(H,23,24,27)