1-butyl-3-[(1R)-1-(4-methylsulfonylphenyl)ethyl]thiourea

Systemtic Name: 1-butyl-3-[(1R)-1-(4-methylsulfonylphenyl)ethyl]thiourea Openeye Name: 1-butyl-3-[(1R)-1-(4-methylsulfonylphenyl)ethyl]thiourea CAS Name: 1-butyl-3-[(1R)-1-(4-methylsulfonylphenyl)ethyl]thiourea IUPAC Name: 1-butyl-3-[(1R)-1-(4-methylsulfonylphenyl)ethyl]thiourea Traditional Name: 1-butyl-3-[(1R)-1-(4-mesylphenyl)ethyl]thiourea Formula: C14H22N2O2S2 MolecularWeight: 314.46668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NC(C)C1=CC=C(C=C1)S(=O)(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C14H22N2O2S2/c1-4-5-10-15-14(19)16-11(2)12-6-8-13(9-7-12)20(3,17)18/h6-9,11H,4-5,10H2,1-3H3,(H2,15,16,19)/t11-/m1/s1