1-(3,5-dimethylphenyl)-3-(5-morpholin-4-ylsulfonyl-2-piperidin-1-yl-phenyl)thiourea

Systemtic Name: 1-(3,5-dimethylphenyl)-3-(5-morpholin-4-ylsulfonyl-2-piperidin-1-yl-phenyl)thiourea Openeye Name: 1-(3,5-dimethylphenyl)-3-[5-morpholinosulfonyl-2-(1-piperidyl)phenyl]thiourea CAS Name: 1-(3,5-dimethylphenyl)-3-[5-(4-morpholinylsulfonyl)-2-(1-piperidinyl)phenyl]thiourea IUPAC Name: 1-(3,5-dimethylphenyl)-3-(5-morpholin-4-ylsulfonyl-2-piperidin-1-ylphenyl)thiourea Traditional Name: 1-(3,5-dimethylphenyl)-3-(5-morpholinosulfonyl-2-piperidino-phenyl)thiourea Formula: C24H32N4O3S2 MolecularWeight: 488.66588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCCC4)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCCC4)C

InChI

InChI=1S/C24H32N4O3S2/c1-18-14-19(2)16-20(15-18)25-24(32)26-22-17-21(33(29,30)28-10-12-31-13-11-28)6-7-23(22)27-8-4-3-5-9-27/h6-7,14-17H,3-5,8-13H2,1-2H3,(H2,25,26,32)