[4-(phenylcarbonylcarbamothioylamino)cyclohexyl]methylcarbamic acid

Systemtic Name: [4-(phenylcarbonylcarbamothioylamino)cyclohexyl]methylcarbamic acid Openeye Name: [4-(benzoylcarbamothioylamino)cyclohexyl]methylcarbamic acid CAS Name: [4-[[benzamido(sulfanylidene)methyl]amino]cyclohexyl]methylcarbamic acid IUPAC Name: [4-(benzoylcarbamothioylamino)cyclohexyl]methylcarbamic acid Traditional Name: [4-(benzoylthiocarbamoylamino)cyclohexyl]methylcarbamic acid Formula: C16H21N3O3S MolecularWeight: 335.42124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CNC(=O)O)NC(=S)NC(=O)C2=CC=CC=C2

Isomeric SMILES

C1CC(CCC1CNC(=O)O)NC(=S)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H21N3O3S/c20-14(12-4-2-1-3-5-12)19-15(23)18-13-8-6-11(7-9-13)10-17-16(21)22/h1-5,11,13,17H,6-10H2,(H,21,22)(H2,18,19,20,23)