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

Systemtic Name: 1-(cyclohexylmethyl)-3-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]thiourea Openeye Name: 1-(cyclohexylmethyl)-3-[4-[(2,6-dimethyl-1-piperidyl)sulfonyl]phenyl]thiourea CAS Name: 1-(cyclohexylmethyl)-3-[4-[(2,6-dimethyl-1-piperidinyl)sulfonyl]phenyl]thiourea IUPAC Name: 1-(cyclohexylmethyl)-3-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]thiourea Traditional Name: 1-(cyclohexylmethyl)-3-[4-(2,6-dimethylpiperidino)sulfonylphenyl]thiourea Formula: C21H33N3O2S2 MolecularWeight: 423.63562

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1S(=O)(=O)C2=CC=C(C=C2)NC(=S)NCC3CCCCC3)C

Isomeric SMILES

CC1CCCC(N1S(=O)(=O)C2=CC=C(C=C2)NC(=S)NCC3CCCCC3)C

InChI

InChI=1S/C21H33N3O2S2/c1-16-7-6-8-17(2)24(16)28(25,26)20-13-11-19(12-14-20)23-21(27)22-15-18-9-4-3-5-10-18/h11-14,16-18H,3-10,15H2,1-2H3,(H2,22,23,27)