1-[1-[(4-methylsulfanylphenyl)carbamoylamino]cyclohexyl]carbonylpiperidine-4-carboxamide

Systemtic Name: 1-[1-[(4-methylsulfanylphenyl)carbamoylamino]cyclohexyl]carbonylpiperidine-4-carboxamide Openeye Name: 1-[1-[(4-methylsulfanylphenyl)carbamoylamino]cyclohexanecarbonyl]piperidine-4-carboxamide CAS Name: 1-[[1-[[[4-(methylthio)anilino]-oxomethyl]amino]cyclohexyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: 1-[1-[(4-methylsulfanylphenyl)carbamoylamino]cyclohexanecarbonyl]piperidine-4-carboxamide Traditional Name: 1-[1-[[4-(methylthio)phenyl]carbamoylamino]cyclohexanecarbonyl]isonipecotamide Formula: C21H30N4O3S MolecularWeight: 418.5529

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)NC(=O)NC2(CCCCC2)C(=O)N3CCC(CC3)C(=O)N

Isomeric SMILES

CSC1=CC=C(C=C1)NC(=O)NC2(CCCCC2)C(=O)N3CCC(CC3)C(=O)N

InChI

InChI=1S/C21H30N4O3S/c1-29-17-7-5-16(6-8-17)23-20(28)24-21(11-3-2-4-12-21)19(27)25-13-9-15(10-14-25)18(22)26/h5-8,15H,2-4,9-14H2,1H3,(H2,22,26)(H2,23,24,28)