1-[(1S,2S)-2-methylcyclohexyl]-3-quinolin-8-yl-thiourea

Systemtic Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-quinolin-8-yl-thiourea Openeye Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-(8-quinolyl)thiourea CAS Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-(8-quinolinyl)thiourea IUPAC Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-quinolin-8-ylthiourea Traditional Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-(8-quinolyl)thiourea Formula: C17H21N3S MolecularWeight: 299.43374

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=S)NC2=CC=CC3=C2N=CC=C3

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=S)NC2=CC=CC3=C2N=CC=C3

InChI

InChI=1S/C17H21N3S/c1-12-6-2-3-9-14(12)19-17(21)20-15-10-4-7-13-8-5-11-18-16(13)15/h4-5,7-8,10-12,14H,2-3,6,9H2,1H3,(H2,19,20,21)/t12-,14-/m0/s1