N-[4-(4-nitrophenyl)butylcarbamothioyl]thiophene-2-carboxamide

Systemtic Name: N-[4-(4-nitrophenyl)butylcarbamothioyl]thiophene-2-carboxamide Openeye Name: N-[4-(4-nitrophenyl)butylcarbamothioyl]thiophene-2-carboxamide CAS Name: N-[[4-(4-nitrophenyl)butylamino]-sulfanylidenemethyl]-2-thiophenecarboxamide IUPAC Name: N-[4-(4-nitrophenyl)butylcarbamothioyl]thiophene-2-carboxamide Traditional Name: N-[4-(4-nitrophenyl)butylthiocarbamoyl]thiophene-2-carboxamide Formula: C16H17N3O3S2 MolecularWeight: 363.45448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=O)NC(=S)NCCCCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CSC(=C1)C(=O)NC(=S)NCCCCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H17N3O3S2/c20-15(14-5-3-11-24-14)18-16(23)17-10-2-1-4-12-6-8-13(9-7-12)19(21)22/h3,5-9,11H,1-2,4,10H2,(H2,17,18,20,23)