3-cyclohexyl-1-[(3R)-1-(4-methylphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]-1-phenethyl-thiourea

Systemtic Name: 3-cyclohexyl-1-[(3R)-1-(4-methylphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]-1-phenethyl-thiourea Openeye Name: 3-cyclohexyl-1-[(3R)-2,5-dioxo-1-(p-tolyl)pyrrolidin-3-yl]-1-phenethyl-thiourea CAS Name: 3-cyclohexyl-1-[(3R)-1-(4-methylphenyl)-2,5-dioxo-3-pyrrolidinyl]-1-phenethylthiourea IUPAC Name: 3-cyclohexyl-1-[(3R)-1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]-1-phenethylthiourea Traditional Name: 3-cyclohexyl-1-[(3R)-2,5-diketo-1-(p-tolyl)pyrrolidin-3-yl]-1-phenethyl-thiourea Formula: C26H31N3O2S MolecularWeight: 449.60824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)CC(C2=O)N(CCC3=CC=CC=C3)C(=S)NC4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C[C@H](C2=O)N(CCC3=CC=CC=C3)C(=S)NC4CCCCC4

InChI

InChI=1S/C26H31N3O2S/c1-19-12-14-22(15-13-19)29-24(30)18-23(25(29)31)28(17-16-20-8-4-2-5-9-20)26(32)27-21-10-6-3-7-11-21/h2,4-5,8-9,12-15,21,23H,3,6-7,10-11,16-18H2,1H3,(H,27,32)/t23-/m1/s1