1-(4-bromanyl-2-ethyl-phenyl)-3-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]thiourea

Systemtic Name: 1-(4-bromanyl-2-ethyl-phenyl)-3-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]thiourea Openeye Name: 1-(4-bromo-2-ethyl-phenyl)-3-[4-[(2,6-dimethyl-1-piperidyl)sulfonyl]phenyl]thiourea CAS Name: 1-(4-bromo-2-ethylphenyl)-3-[4-[(2,6-dimethyl-1-piperidinyl)sulfonyl]phenyl]thiourea IUPAC Name: 1-(4-bromo-2-ethylphenyl)-3-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]thiourea Traditional Name: 1-(4-bromo-2-ethyl-phenyl)-3-[4-(2,6-dimethylpiperidino)sulfonylphenyl]thiourea Formula: C22H28BrN3O2S2 MolecularWeight: 510.51062

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)Br)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3C(CCCC3C)C

Isomeric SMILES

CCC1=C(C=CC(=C1)Br)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3C(CCCC3C)C

InChI

InChI=1S/C22H28BrN3O2S2/c1-4-17-14-18(23)8-13-21(17)25-22(29)24-19-9-11-20(12-10-19)30(27,28)26-15(2)6-5-7-16(26)3/h8-16H,4-7H2,1-3H3,(H2,24,25,29)