1-[(1S,2S)-2-methylcyclohexyl]-3-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)thiourea

Systemtic Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)thiourea Openeye Name: 1-(2-hydroxy-5-pyrrolidin-1-ylsulfonyl-phenyl)-3-[(1S,2S)-2-methylcyclohexyl]thiourea CAS Name: 1-[2-hydroxy-5-(1-pyrrolidinylsulfonyl)phenyl]-3-[(1S,2S)-2-methylcyclohexyl]thiourea IUPAC Name: 1-(2-hydroxy-5-pyrrolidin-1-ylsulfonylphenyl)-3-[(1S,2S)-2-methylcyclohexyl]thiourea Traditional Name: 1-(2-hydroxy-5-pyrrolidinosulfonyl-phenyl)-3-[(1S,2S)-2-methylcyclohexyl]thiourea Formula: C18H27N3O3S2 MolecularWeight: 397.55528

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=S)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)O

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=S)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)O

InChI

InChI=1S/C18H27N3O3S2/c1-13-6-2-3-7-15(13)19-18(25)20-16-12-14(8-9-17(16)22)26(23,24)21-10-4-5-11-21/h8-9,12-13,15,22H,2-7,10-11H2,1H3,(H2,19,20,25)/t13-,15-/m0/s1