(3S)-3-[[(4-propan-2-ylphenyl)carbamothioylamino]carbamoyl]piperidine-1-carboxamide

Systemtic Name: (3S)-3-[[(4-propan-2-ylphenyl)carbamothioylamino]carbamoyl]piperidine-1-carboxamide Openeye Name: (3S)-3-[[(4-isopropylphenyl)carbamothioylamino]carbamoyl]piperidine-1-carboxamide CAS Name: (3S)-3-[oxo-[[(4-propan-2-ylanilino)-sulfanylidenemethyl]hydrazo]methyl]-1-piperidinecarboxamide IUPAC Name: (3S)-3-[[(4-propan-2-ylphenyl)carbamothioylamino]carbamoyl]piperidine-1-carboxamide Traditional Name: (3S)-3-[(p-cumenylthiocarbamoylamino)carbamoyl]piperidine-1-carboxamide Formula: C17H25N5O2S MolecularWeight: 363.4777

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25N5O2S/c1-11(2)12-5-7-14(8-6-12)19-17(25)21-20-15(23)13-4-3-9-22(10-13)16(18)24/h5-8,11,13H,3-4,9-10H2,1-2H3,(H2,18,24)(H,20,23)(H2,19,21,25)/t13-/m0/s1