1-[(2S)-2-ethylhexyl]-3-[(1R)-1-(4-methylsulfonylphenyl)ethyl]thiourea

Systemtic Name: 1-[(2S)-2-ethylhexyl]-3-[(1R)-1-(4-methylsulfonylphenyl)ethyl]thiourea Openeye Name: 1-[(2S)-2-ethylhexyl]-3-[(1R)-1-(4-methylsulfonylphenyl)ethyl]thiourea CAS Name: 1-[(2S)-2-ethylhexyl]-3-[(1R)-1-(4-methylsulfonylphenyl)ethyl]thiourea IUPAC Name: 1-[(2S)-2-ethylhexyl]-3-[(1R)-1-(4-methylsulfonylphenyl)ethyl]thiourea Traditional Name: 1-[(2S)-2-ethylhexyl]-3-[(1R)-1-(4-mesylphenyl)ethyl]thiourea Formula: C18H30N2O2S2 MolecularWeight: 370.573

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=S)NC(C)C1=CC=C(C=C1)S(=O)(=O)C

Isomeric SMILES

CCCC[C@H](CC)CNC(=S)N[C@H](C)C1=CC=C(C=C1)S(=O)(=O)C

InChI

InChI=1S/C18H30N2O2S2/c1-5-7-8-15(6-2)13-19-18(23)20-14(3)16-9-11-17(12-10-16)24(4,21)22/h9-12,14-15H,5-8,13H2,1-4H3,(H2,19,20,23)/t14-,15+/m1/s1