N-phenyl-3-[(propan-2-ylcarbamothioylamino)carbamoyl]piperidine-1-carboxamide

Systemtic Name: N-phenyl-3-[(propan-2-ylcarbamothioylamino)carbamoyl]piperidine-1-carboxamide Openeye Name: 3-[(isopropylcarbamothioylamino)carbamoyl]-N-phenyl-piperidine-1-carboxamide CAS Name: 3-[oxo-[[(propan-2-ylamino)-sulfanylidenemethyl]hydrazo]methyl]-N-phenyl-1-piperidinecarboxamide IUPAC Name: N-phenyl-3-[(propan-2-ylcarbamothioylamino)carbamoyl]piperidine-1-carboxamide Traditional Name: 3-[(isopropylthiocarbamoylamino)carbamoyl]-N-phenyl-piperidine-1-carboxamide Formula: C17H25N5O2S MolecularWeight: 363.4777

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=S)NNC(=O)C1CCCN(C1)C(=O)NC2=CC=CC=C2

Isomeric SMILES

CC(C)NC(=S)NNC(=O)C1CCCN(C1)C(=O)NC2=CC=CC=C2

InChI

InChI=1S/C17H25N5O2S/c1-12(2)18-16(25)21-20-15(23)13-7-6-10-22(11-13)17(24)19-14-8-4-3-5-9-14/h3-5,8-9,12-13H,6-7,10-11H2,1-2H3,(H,19,24)(H,20,23)(H2,18,21,25)