N-[2-(cyclohexen-1-yl)ethylcarbamothioyl]-3-nitro-benzamide

Systemtic Name: N-[2-(cyclohexen-1-yl)ethylcarbamothioyl]-3-nitro-benzamide Openeye Name: N-[2-(cyclohexen-1-yl)ethylcarbamothioyl]-3-nitro-benzamide CAS Name: N-[[2-(1-cyclohexenyl)ethylamino]-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: N-[2-(cyclohexen-1-yl)ethylcarbamothioyl]-3-nitrobenzamide Traditional Name: N-[2-(cyclohexen-1-yl)ethylthiocarbamoyl]-3-nitro-benzamide Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CCNC(=S)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCC(=CC1)CCNC(=S)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H19N3O3S/c20-15(13-7-4-8-14(11-13)19(21)22)18-16(23)17-10-9-12-5-2-1-3-6-12/h4-5,7-8,11H,1-3,6,9-10H2,(H2,17,18,20,23)