4-methyl-N-[[(1R,5R)-1,3,3-trimethyl-5-oxidanyl-cyclohexyl]methyl]benzenecarbothioamide

Systemtic Name: 4-methyl-N-[[(1R,5R)-1,3,3-trimethyl-5-oxidanyl-cyclohexyl]methyl]benzenecarbothioamide Openeye Name: N-[[(1R,5R)-5-hydroxy-1,3,3-trimethyl-cyclohexyl]methyl]-4-methyl-benzenecarbothioamide CAS Name: N-[[(1R,5R)-5-hydroxy-1,3,3-trimethylcyclohexyl]methyl]-4-methylbenzenecarbothioamide IUPAC Name: N-[[(1R,5R)-5-hydroxy-1,3,3-trimethylcyclohexyl]methyl]-4-methylbenzenecarbothioamide Traditional Name: N-[[(1R,5R)-5-hydroxy-1,3,3-trimethyl-cyclohexyl]methyl]-4-methyl-thiobenzamide Formula: C18H27NOS MolecularWeight: 305.47808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=S)NCC2(CC(CC(C2)(C)C)O)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=S)NC[C@]2(C[C@@H](CC(C2)(C)C)O)C

InChI

InChI=1S/C18H27NOS/c1-13-5-7-14(8-6-13)16(21)19-12-18(4)10-15(20)9-17(2,3)11-18/h5-8,15,20H,9-12H2,1-4H3,(H,19,21)/t15-,18+/m1/s1