1-(5-bromanylpyridin-2-yl)-3-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]thiourea

Systemtic Name: 1-(5-bromanylpyridin-2-yl)-3-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]thiourea Openeye Name: 1-(5-bromo-2-pyridyl)-3-[4-[(2,6-dimethyl-1-piperidyl)sulfonyl]phenyl]thiourea CAS Name: 1-(5-bromo-2-pyridinyl)-3-[4-[(2,6-dimethyl-1-piperidinyl)sulfonyl]phenyl]thiourea IUPAC Name: 1-(5-bromopyridin-2-yl)-3-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]thiourea Traditional Name: 1-(5-bromo-2-pyridyl)-3-[4-(2,6-dimethylpiperidino)sulfonylphenyl]thiourea Formula: C19H23BrN4O2S2 MolecularWeight: 483.44552

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23BrN4O2S2/c1-13-4-3-5-14(2)24(13)28(25,26)17-9-7-16(8-10-17)22-19(27)23-18-11-6-15(20)12-21-18/h6-14H,3-5H2,1-2H3,(H2,21,22,23,27)