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

Systemtic Name: 1-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]-3-(1-thiophen-2-ylethyl)thiourea Openeye Name: 1-[4-[(2,6-dimethyl-1-piperidyl)sulfonyl]phenyl]-3-[1-(2-thienyl)ethyl]thiourea CAS Name: 1-[4-[(2,6-dimethyl-1-piperidinyl)sulfonyl]phenyl]-3-(1-thiophen-2-ylethyl)thiourea IUPAC Name: 1-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]-3-(1-thiophen-2-ylethyl)thiourea Traditional Name: 1-[4-(2,6-dimethylpiperidino)sulfonylphenyl]-3-[1-(2-thienyl)ethyl]thiourea Formula: C20H27N3O2S3 MolecularWeight: 437.64228

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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=CS3)C

Isomeric SMILES

CC1CCCC(N1S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(C)C3=CC=CS3)C

InChI

InChI=1S/C20H27N3O2S3/c1-14-6-4-7-15(2)23(14)28(24,25)18-11-9-17(10-12-18)22-20(26)21-16(3)19-8-5-13-27-19/h5,8-16H,4,6-7H2,1-3H3,(H2,21,22,26)