1-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)-3-(4-propan-2-ylphenyl)thiourea

Systemtic Name: 1-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)-3-(4-propan-2-ylphenyl)thiourea Openeye Name: 1-(4-isopropylphenyl)-3-[2-methyl-5-(1-piperidylsulfonyl)phenyl]thiourea CAS Name: 1-[2-methyl-5-(1-piperidinylsulfonyl)phenyl]-3-(4-propan-2-ylphenyl)thiourea IUPAC Name: 1-(2-methyl-5-piperidin-1-ylsulfonylphenyl)-3-(4-propan-2-ylphenyl)thiourea Traditional Name: 1-(2-methyl-5-piperidinosulfonyl-phenyl)-3-p-cumenyl-thiourea Formula: C22H29N3O2S2 MolecularWeight: 431.61456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=S)NC3=CC=C(C=C3)C(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=S)NC3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C22H29N3O2S2/c1-16(2)18-8-10-19(11-9-18)23-22(28)24-21-15-20(12-7-17(21)3)29(26,27)25-13-5-4-6-14-25/h7-12,15-16H,4-6,13-14H2,1-3H3,(H2,23,24,28)