(3S)-3-[[(4-methoxyphenyl)methylcarbamothioylamino]carbamoyl]piperidine-1-carboxamide

Systemtic Name: (3S)-3-[[(4-methoxyphenyl)methylcarbamothioylamino]carbamoyl]piperidine-1-carboxamide Openeye Name: (3S)-3-[[(4-methoxyphenyl)methylcarbamothioylamino]carbamoyl]piperidine-1-carboxamide CAS Name: (3S)-3-[[[[(4-methoxyphenyl)methylamino]-sulfanylidenemethyl]hydrazo]-oxomethyl]-1-piperidinecarboxamide IUPAC Name: (3S)-3-[[(4-methoxyphenyl)methylcarbamothioylamino]carbamoyl]piperidine-1-carboxamide Traditional Name: (3S)-3-[(p-anisylthiocarbamoylamino)carbamoyl]piperidine-1-carboxamide Formula: C16H23N5O3S MolecularWeight: 365.45052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=S)NNC(=O)C2CCCN(C2)C(=O)N

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=S)NNC(=O)[C@H]2CCCN(C2)C(=O)N

InChI

InChI=1S/C16H23N5O3S/c1-24-13-6-4-11(5-7-13)9-18-16(25)20-19-14(22)12-3-2-8-21(10-12)15(17)23/h4-7,12H,2-3,8-10H2,1H3,(H2,17,23)(H,19,22)(H2,18,20,25)/t12-/m0/s1