1-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]-3-[1-(4-ethoxyphenyl)propyl]thiourea

Systemtic Name: 1-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]-3-[1-(4-ethoxyphenyl)propyl]thiourea Openeye Name: 1-[4-[(2,6-dimethyl-1-piperidyl)sulfonyl]phenyl]-3-[1-(4-ethoxyphenyl)propyl]thiourea CAS Name: 1-[4-[(2,6-dimethyl-1-piperidinyl)sulfonyl]phenyl]-3-[1-(4-ethoxyphenyl)propyl]thiourea IUPAC Name: 1-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]-3-[1-(4-ethoxyphenyl)propyl]thiourea Traditional Name: 1-[4-(2,6-dimethylpiperidino)sulfonylphenyl]-3-(1-p-phenetylpropyl)thiourea Formula: C25H35N3O3S2 MolecularWeight: 489.6937

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)OCC)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3C(CCCC3C)C

Isomeric SMILES

CCC(C1=CC=C(C=C1)OCC)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3C(CCCC3C)C

InChI

InChI=1S/C25H35N3O3S2/c1-5-24(20-10-14-22(15-11-20)31-6-2)27-25(32)26-21-12-16-23(17-13-21)33(29,30)28-18(3)8-7-9-19(28)4/h10-19,24H,5-9H2,1-4H3,(H2,26,27,32)