N-[[4-(butanoylamino)phenyl]carbamothioyl]thiophene-2-carboxamide

Systemtic Name: N-[[4-(butanoylamino)phenyl]carbamothioyl]thiophene-2-carboxamide Openeye Name: N-[[4-(butanoylamino)phenyl]carbamothioyl]thiophene-2-carboxamide CAS Name: N-[[4-(1-oxobutylamino)anilino]-sulfanylidenemethyl]-2-thiophenecarboxamide IUPAC Name: N-[[4-(butanoylamino)phenyl]carbamothioyl]thiophene-2-carboxamide Traditional Name: N-[(4-butyramidophenyl)thiocarbamoyl]thiophene-2-carboxamide Formula: C16H17N3O2S2 MolecularWeight: 347.45508

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=CS2

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=CS2

InChI

InChI=1S/C16H17N3O2S2/c1-2-4-14(20)17-11-6-8-12(9-7-11)18-16(22)19-15(21)13-5-3-10-23-13/h3,5-10H,2,4H2,1H3,(H,17,20)(H2,18,19,21,22)