1-butyl-3-[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]thiourea

Systemtic Name: 1-butyl-3-[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]thiourea Openeye Name: 1-butyl-3-[4-[(3,5-dimethyl-1-piperidyl)sulfonyl]phenyl]thiourea CAS Name: 1-butyl-3-[4-[(3,5-dimethyl-1-piperidinyl)sulfonyl]phenyl]thiourea IUPAC Name: 1-butyl-3-[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]thiourea Traditional Name: 1-butyl-3-[4-(3,5-dimethylpiperidino)sulfonylphenyl]thiourea Formula: C18H29N3O2S2 MolecularWeight: 383.57176

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NC1=CC=C(C=C1)S(=O)(=O)N2CC(CC(C2)C)C

Isomeric SMILES

CCCCNC(=S)NC1=CC=C(C=C1)S(=O)(=O)N2CC(CC(C2)C)C

InChI

InChI=1S/C18H29N3O2S2/c1-4-5-10-19-18(24)20-16-6-8-17(9-7-16)25(22,23)21-12-14(2)11-15(3)13-21/h6-9,14-15H,4-5,10-13H2,1-3H3,(H2,19,20,24)