1-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]-3-(4-propan-2-ylphenyl)thiourea

Systemtic Name: 1-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]-3-(4-propan-2-ylphenyl)thiourea Openeye Name: 1-(4-isopropylphenyl)-3-[4-[(3-methyl-1-piperidyl)sulfonyl]phenyl]thiourea CAS Name: 1-[4-[(3-methyl-1-piperidinyl)sulfonyl]phenyl]-3-(4-propan-2-ylphenyl)thiourea IUPAC Name: 1-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]-3-(4-propan-2-ylphenyl)thiourea Traditional Name: 1-[4-(3-methylpiperidino)sulfonylphenyl]-3-p-cumenyl-thiourea Formula: C22H29N3O2S2 MolecularWeight: 431.61456

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CC=C(C=C3)C(C)C

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C22H29N3O2S2/c1-16(2)18-6-8-19(9-7-18)23-22(28)24-20-10-12-21(13-11-20)29(26,27)25-14-4-5-17(3)15-25/h6-13,16-17H,4-5,14-15H2,1-3H3,(H2,23,24,28)