N-[(2S)-1-[2-(cyclopentylcarbamothioyl)hydrazinyl]-1-oxidanylidene-propan-2-yl]-3-nitro-benzamide

Systemtic Name: N-[(2S)-1-[2-(cyclopentylcarbamothioyl)hydrazinyl]-1-oxidanylidene-propan-2-yl]-3-nitro-benzamide Openeye Name: N-[(1S)-2-[2-(cyclopentylcarbamothioyl)hydrazino]-1-methyl-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-[(2S)-1-[[(cyclopentylamino)-sulfanylidenemethyl]hydrazo]-1-oxopropan-2-yl]-3-nitrobenzamide IUPAC Name: N-[(2S)-1-[2-(cyclopentylcarbamothioyl)hydrazinyl]-1-oxopropan-2-yl]-3-nitrobenzamide Traditional Name: N-[(1S)-2-[N'-(cyclopentylthiocarbamoyl)hydrazino]-2-keto-1-methyl-ethyl]-3-nitro-benzamide Formula: C16H21N5O4S MolecularWeight: 379.43404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NNC(=S)NC1CCCC1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C(=O)NNC(=S)NC1CCCC1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H21N5O4S/c1-10(14(22)19-20-16(26)18-12-6-2-3-7-12)17-15(23)11-5-4-8-13(9-11)21(24)25/h4-5,8-10,12H,2-3,6-7H2,1H3,(H,17,23)(H,19,22)(H2,18,20,26)/t10-/m0/s1