1-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-3-(4-phenoxyphenyl)thiourea

Systemtic Name: 1-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-3-(4-phenoxyphenyl)thiourea Openeye Name: 1-[(2R,6R)-2,6-dimethyl-1-piperidyl]-3-(4-phenoxyphenyl)thiourea CAS Name: 1-[(2R,6R)-2,6-dimethyl-1-piperidinyl]-3-(4-phenoxyphenyl)thiourea IUPAC Name: 1-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-3-(4-phenoxyphenyl)thiourea Traditional Name: 1-[(2R,6R)-2,6-dimethylpiperidino]-3-(4-phenoxyphenyl)thiourea Formula: C20H25N3OS MolecularWeight: 355.497

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1NC(=S)NC2=CC=C(C=C2)OC3=CC=CC=C3)C

Isomeric SMILES

C[C@@H]1CCC[C@H](N1NC(=S)NC2=CC=C(C=C2)OC3=CC=CC=C3)C

InChI

InChI=1S/C20H25N3OS/c1-15-7-6-8-16(2)23(15)22-20(25)21-17-11-13-19(14-12-17)24-18-9-4-3-5-10-18/h3-5,9-16H,6-8H2,1-2H3,(H2,21,22,25)/t15-,16-/m1/s1