1-[(1R,2S)-2-methylcyclohexyl]-3-(pyridin-4-ylmethyl)thiourea

Systemtic Name: 1-[(1R,2S)-2-methylcyclohexyl]-3-(pyridin-4-ylmethyl)thiourea Openeye Name: 1-[(1R,2S)-2-methylcyclohexyl]-3-(4-pyridylmethyl)thiourea CAS Name: 1-[(1R,2S)-2-methylcyclohexyl]-3-(pyridin-4-ylmethyl)thiourea IUPAC Name: 1-[(1R,2S)-2-methylcyclohexyl]-3-(pyridin-4-ylmethyl)thiourea Traditional Name: 1-[(1R,2S)-2-methylcyclohexyl]-3-(4-pyridylmethyl)thiourea Formula: C14H21N3S MolecularWeight: 263.40164

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=S)NCC2=CC=NC=C2

Isomeric SMILES

C[C@H]1CCCC[C@H]1NC(=S)NCC2=CC=NC=C2

InChI

InChI=1S/C14H21N3S/c1-11-4-2-3-5-13(11)17-14(18)16-10-12-6-8-15-9-7-12/h6-9,11,13H,2-5,10H2,1H3,(H2,16,17,18)/t11-,13+/m0/s1