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

Systemtic Name: 1-(3,4-dimethoxyphenyl)-3-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]thiourea Openeye Name: 1-(3,4-dimethoxyphenyl)-3-[4-[(2,6-dimethyl-1-piperidyl)sulfonyl]phenyl]thiourea CAS Name: 1-(3,4-dimethoxyphenyl)-3-[4-[(2,6-dimethyl-1-piperidinyl)sulfonyl]phenyl]thiourea IUPAC Name: 1-(3,4-dimethoxyphenyl)-3-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]thiourea Traditional Name: 1-(3,4-dimethoxyphenyl)-3-[4-(2,6-dimethylpiperidino)sulfonylphenyl]thiourea Formula: C22H29N3O4S2 MolecularWeight: 463.61336

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CC(=C(C=C3)OC)OC)C

Isomeric SMILES

CC1CCCC(N1S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CC(=C(C=C3)OC)OC)C

InChI

InChI=1S/C22H29N3O4S2/c1-15-6-5-7-16(2)25(15)31(26,27)19-11-8-17(9-12-19)23-22(30)24-18-10-13-20(28-3)21(14-18)29-4/h8-16H,5-7H2,1-4H3,(H2,23,24,30)