1-[(1S,2S)-2-methylcyclohexyl]-3-(1H-pyrrol-2-ylcarbonylamino)thiourea

Systemtic Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-(1H-pyrrol-2-ylcarbonylamino)thiourea Openeye Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-(1H-pyrrole-2-carbonylamino)thiourea CAS Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-[[oxo(1H-pyrrol-2-yl)methyl]amino]thiourea IUPAC Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-(1H-pyrrole-2-carbonylamino)thiourea Traditional Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-(1H-pyrrole-2-carbonylamino)thiourea Formula: C13H20N4OS MolecularWeight: 280.3891

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=S)NNC(=O)C2=CC=CN2

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=S)NNC(=O)C2=CC=CN2

InChI

InChI=1S/C13H20N4OS/c1-9-5-2-3-6-10(9)15-13(19)17-16-12(18)11-7-4-8-14-11/h4,7-10,14H,2-3,5-6H2,1H3,(H,16,18)(H2,15,17,19)/t9-,10-/m0/s1