1-[(1S,2S)-2-methylcyclohexyl]-3-[(Z)-1-(4-methylsulfonylphenyl)ethylideneamino]thiourea

Systemtic Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-[(Z)-1-(4-methylsulfonylphenyl)ethylideneamino]thiourea Openeye Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-[(Z)-1-(4-methylsulfonylphenyl)ethylideneamino]thiourea CAS Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-[(Z)-1-(4-methylsulfonylphenyl)ethylideneamino]thiourea IUPAC Name: 1-[(1S,2S)-2-methylcyclohexyl]-3-[(Z)-1-(4-methylsulfonylphenyl)ethylideneamino]thiourea Traditional Name: 1-[(Z)-1-(4-mesylphenyl)ethylideneamino]-3-[(1S,2S)-2-methylcyclohexyl]thiourea Formula: C17H25N3O2S2 MolecularWeight: 367.5293

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=S)NN=C(C)C2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=S)N/N=C(/C)\C2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C17H25N3O2S2/c1-12-6-4-5-7-16(12)18-17(23)20-19-13(2)14-8-10-15(11-9-14)24(3,21)22/h8-12,16H,4-7H2,1-3H3,(H2,18,20,23)/b19-13-/t12-,16-/m0/s1