1-[(1S,2S)-2-methylcyclohexyl]-3-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)thiourea

Systemtic Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)thiourea Openeye Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-[2-methyl-5-(1-piperidylsulfonyl)phenyl]thiourea CAS Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-[2-methyl-5-(1-piperidinylsulfonyl)phenyl]thiourea IUPAC Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-(2-methyl-5-piperidin-1-ylsulfonylphenyl)thiourea Traditional Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-(2-methyl-5-piperidinosulfonyl-phenyl)thiourea Formula: C20H31N3O2S2 MolecularWeight: 409.60904

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=S)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)C

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=S)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)C

InChI

InChI=1S/C20H31N3O2S2/c1-15-8-4-5-9-18(15)21-20(26)22-19-14-17(11-10-16(19)2)27(24,25)23-12-6-3-7-13-23/h10-11,14-15,18H,3-9,12-13H2,1-2H3,(H2,21,22,26)/t15-,18-/m0/s1