N-[(2-methyl-3-nitro-phenyl)carbamothioyl]cyclopentanecarboxamide

Systemtic Name: N-[(2-methyl-3-nitro-phenyl)carbamothioyl]cyclopentanecarboxamide Openeye Name: N-[(2-methyl-3-nitro-phenyl)carbamothioyl]cyclopentanecarboxamide CAS Name: N-[(2-methyl-3-nitroanilino)-sulfanylidenemethyl]cyclopentanecarboxamide IUPAC Name: N-[(2-methyl-3-nitrophenyl)carbamothioyl]cyclopentanecarboxamide Traditional Name: N-[(2-methyl-3-nitro-phenyl)thiocarbamoyl]cyclopentanecarboxamide Formula: C14H17N3O3S MolecularWeight: 307.36808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=S)NC(=O)C2CCCC2

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=S)NC(=O)C2CCCC2

InChI

InChI=1S/C14H17N3O3S/c1-9-11(7-4-8-12(9)17(19)20)15-14(21)16-13(18)10-5-2-3-6-10/h4,7-8,10H,2-3,5-6H2,1H3,(H2,15,16,18,21)