1-cyclopentyl-3-[[1-(2,4,6-trimethylphenyl)sulfonylpiperidin-4-yl]carbonylamino]thiourea

Systemtic Name: 1-cyclopentyl-3-[[1-(2,4,6-trimethylphenyl)sulfonylpiperidin-4-yl]carbonylamino]thiourea Openeye Name: 1-cyclopentyl-3-[[1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carbonyl]amino]thiourea CAS Name: 1-cyclopentyl-3-[[oxo-[1-(2,4,6-trimethylphenyl)sulfonyl-4-piperidinyl]methyl]amino]thiourea IUPAC Name: 1-cyclopentyl-3-[[1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carbonyl]amino]thiourea Traditional Name: 1-cyclopentyl-3-[(1-mesitylsulfonylisonipecotoyl)amino]thiourea Formula: C21H32N4O3S2 MolecularWeight: 452.63378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)NNC(=S)NC3CCCC3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)NNC(=S)NC3CCCC3)C

InChI

InChI=1S/C21H32N4O3S2/c1-14-12-15(2)19(16(3)13-14)30(27,28)25-10-8-17(9-11-25)20(26)23-24-21(29)22-18-6-4-5-7-18/h12-13,17-18H,4-11H2,1-3H3,(H,23,26)(H2,22,24,29)