1-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]-3-(1-phenylethyl)thiourea

Systemtic Name: 1-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]-3-(1-phenylethyl)thiourea Openeye Name: 1-[4-[(2,6-dimethyl-1-piperidyl)sulfonyl]phenyl]-3-(1-phenylethyl)thiourea CAS Name: 1-[4-[(2,6-dimethyl-1-piperidinyl)sulfonyl]phenyl]-3-(1-phenylethyl)thiourea IUPAC Name: 1-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]-3-(1-phenylethyl)thiourea Traditional Name: 1-[4-(2,6-dimethylpiperidino)sulfonylphenyl]-3-(1-phenylethyl)thiourea Formula: C22H29N3O2S2 MolecularWeight: 431.61456

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(C)C3=CC=CC=C3)C

Isomeric SMILES

CC1CCCC(N1S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(C)C3=CC=CC=C3)C

InChI

InChI=1S/C22H29N3O2S2/c1-16-8-7-9-17(2)25(16)29(26,27)21-14-12-20(13-15-21)24-22(28)23-18(3)19-10-5-4-6-11-19/h4-6,10-18H,7-9H2,1-3H3,(H2,23,24,28)