1-[(2S,6S)-2,6-dimethylpiperidin-1-yl]-3-(4-morpholin-4-ylsulfonylphenyl)thiourea

Systemtic Name: 1-[(2S,6S)-2,6-dimethylpiperidin-1-yl]-3-(4-morpholin-4-ylsulfonylphenyl)thiourea Openeye Name: 1-[(2S,6S)-2,6-dimethyl-1-piperidyl]-3-(4-morpholinosulfonylphenyl)thiourea CAS Name: 1-[(2S,6S)-2,6-dimethyl-1-piperidinyl]-3-[4-(4-morpholinylsulfonyl)phenyl]thiourea IUPAC Name: 1-[(2S,6S)-2,6-dimethylpiperidin-1-yl]-3-(4-morpholin-4-ylsulfonylphenyl)thiourea Traditional Name: 1-[(2S,6S)-2,6-dimethylpiperidino]-3-(4-morpholinosulfonylphenyl)thiourea Formula: C18H28N4O3S2 MolecularWeight: 412.56992

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)C

Isomeric SMILES

C[C@H]1CCC[C@@H](N1NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)C

InChI

InChI=1S/C18H28N4O3S2/c1-14-4-3-5-15(2)22(14)20-18(26)19-16-6-8-17(9-7-16)27(23,24)21-10-12-25-13-11-21/h6-9,14-15H,3-5,10-13H2,1-2H3,(H2,19,20,26)/t14-,15-/m0/s1