1-[(1S,2S)-2-methylcyclohexyl]-3-(4-pyrrolidin-1-ylsulfonylphenyl)thiourea

Systemtic Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-(4-pyrrolidin-1-ylsulfonylphenyl)thiourea Openeye Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-(4-pyrrolidin-1-ylsulfonylphenyl)thiourea CAS Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-[4-(1-pyrrolidinylsulfonyl)phenyl]thiourea IUPAC Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-(4-pyrrolidin-1-ylsulfonylphenyl)thiourea Traditional Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-(4-pyrrolidinosulfonylphenyl)thiourea Formula: C18H27N3O2S2 MolecularWeight: 381.55588

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27N3O2S2/c1-14-6-2-3-7-17(14)20-18(24)19-15-8-10-16(11-9-15)25(22,23)21-12-4-5-13-21/h8-11,14,17H,2-7,12-13H2,1H3,(H2,19,20,24)/t14-,17-/m0/s1