(3S)-3-[[[(2R)-1-methoxypropan-2-yl]carbamothioylamino]carbamoyl]-N-phenyl-piperidine-1-carboxamide

Systemtic Name: (3S)-3-[[[(2R)-1-methoxypropan-2-yl]carbamothioylamino]carbamoyl]-N-phenyl-piperidine-1-carboxamide Openeye Name: (3S)-3-[[[(1R)-2-methoxy-1-methyl-ethyl]carbamothioylamino]carbamoyl]-N-phenyl-piperidine-1-carboxamide CAS Name: (3S)-3-[[[[[(2R)-1-methoxypropan-2-yl]amino]-sulfanylidenemethyl]hydrazo]-oxomethyl]-N-phenyl-1-piperidinecarboxamide IUPAC Name: (3S)-3-[[[(2R)-1-methoxypropan-2-yl]carbamothioylamino]carbamoyl]-N-phenylpiperidine-1-carboxamide Traditional Name: (3S)-3-[[[(1R)-2-methoxy-1-methyl-ethyl]thiocarbamoylamino]carbamoyl]-N-phenyl-piperidine-1-carboxamide Formula: C18H27N5O3S MolecularWeight: 393.50368

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](COC)NC(=S)NNC(=O)[C@H]1CCCN(C1)C(=O)NC2=CC=CC=C2

InChI

InChI=1S/C18H27N5O3S/c1-13(12-26-2)19-17(27)22-21-16(24)14-7-6-10-23(11-14)18(25)20-15-8-4-3-5-9-15/h3-5,8-9,13-14H,6-7,10-12H2,1-2H3,(H,20,25)(H,21,24)(H2,19,22,27)/t13-,14+/m1/s1