N-[3-(butanoylamino)phenyl]-2-chloranyl-4-(1,2,4-triazol-4-yl)benzamide

Systemtic Name: N-[3-(butanoylamino)phenyl]-2-chloranyl-4-(1,2,4-triazol-4-yl)benzamide Openeye Name: N-[3-(butanoylamino)phenyl]-2-chloro-4-(1,2,4-triazol-4-yl)benzamide CAS Name: 2-chloro-N-[3-(1-oxobutylamino)phenyl]-4-(1,2,4-triazol-4-yl)benzamide IUPAC Name: N-[3-(butanoylamino)phenyl]-2-chloro-4-(1,2,4-triazol-4-yl)benzamide Traditional Name: N-(3-butyramidophenyl)-2-chloro-4-(1,2,4-triazol-4-yl)benzamide Formula: C19H18ClN5O2 MolecularWeight: 383.83152

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=CC(=C1)NC(=O)C2=C(C=C(C=C2)N3C=NN=C3)Cl

Isomeric SMILES

CCCC(=O)NC1=CC=CC(=C1)NC(=O)C2=C(C=C(C=C2)N3C=NN=C3)Cl

InChI

InChI=1S/C19H18ClN5O2/c1-2-4-18(26)23-13-5-3-6-14(9-13)24-19(27)16-8-7-15(10-17(16)20)25-11-21-22-12-25/h3,5-12H,2,4H2,1H3,(H,23,26)(H,24,27)