1-(3,4-dimethylphenyl)-3-[2-(1-thiophen-2-ylsulfonylpiperidin-2-yl)ethyl]urea

Systemtic Name: 1-(3,4-dimethylphenyl)-3-[2-(1-thiophen-2-ylsulfonylpiperidin-2-yl)ethyl]urea Openeye Name: 1-(3,4-dimethylphenyl)-3-[2-[1-(2-thienylsulfonyl)-2-piperidyl]ethyl]urea CAS Name: 1-(3,4-dimethylphenyl)-3-[2-(1-thiophen-2-ylsulfonyl-2-piperidinyl)ethyl]urea IUPAC Name: 1-(3,4-dimethylphenyl)-3-[2-(1-thiophen-2-ylsulfonylpiperidin-2-yl)ethyl]urea Traditional Name: 1-(3,4-dimethylphenyl)-3-[2-[1-(2-thienylsulfonyl)-2-piperidyl]ethyl]urea Formula: C20H27N3O3S2 MolecularWeight: 421.57668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NCCC2CCCCN2S(=O)(=O)C3=CC=CS3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NCCC2CCCCN2S(=O)(=O)C3=CC=CS3)C

InChI

InChI=1S/C20H27N3O3S2/c1-15-8-9-17(14-16(15)2)22-20(24)21-11-10-18-6-3-4-12-23(18)28(25,26)19-7-5-13-27-19/h5,7-9,13-14,18H,3-4,6,10-12H2,1-2H3,(H2,21,22,24)