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

Systemtic Name: 1-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]-3-(1-naphthalen-1-ylethyl)thiourea Openeye Name: 1-[4-[(2,6-dimethyl-1-piperidyl)sulfonyl]phenyl]-3-[1-(1-naphthyl)ethyl]thiourea CAS Name: 1-[4-[(2,6-dimethyl-1-piperidinyl)sulfonyl]phenyl]-3-[1-(1-naphthalenyl)ethyl]thiourea IUPAC Name: 1-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]-3-(1-naphthalen-1-ylethyl)thiourea Traditional Name: 1-[4-(2,6-dimethylpiperidino)sulfonylphenyl]-3-[1-(1-naphthyl)ethyl]thiourea Formula: C26H31N3O2S2 MolecularWeight: 481.67324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(C)C3=CC=CC4=CC=CC=C43)C

Isomeric SMILES

CC1CCCC(N1S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(C)C3=CC=CC4=CC=CC=C43)C

InChI

InChI=1S/C26H31N3O2S2/c1-18-8-6-9-19(2)29(18)33(30,31)23-16-14-22(15-17-23)28-26(32)27-20(3)24-13-7-11-21-10-4-5-12-25(21)24/h4-5,7,10-20H,6,8-9H2,1-3H3,(H2,27,28,32)