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

Systemtic Name: 1-(2,5-dimethylphenyl)-3-(5-morpholin-4-ylsulfonyl-2-piperidin-1-yl-phenyl)thiourea Openeye Name: 1-(2,5-dimethylphenyl)-3-[5-morpholinosulfonyl-2-(1-piperidyl)phenyl]thiourea CAS Name: 1-(2,5-dimethylphenyl)-3-[5-(4-morpholinylsulfonyl)-2-(1-piperidinyl)phenyl]thiourea IUPAC Name: 1-(2,5-dimethylphenyl)-3-(5-morpholin-4-ylsulfonyl-2-piperidin-1-ylphenyl)thiourea Traditional Name: 1-(2,5-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(=C(C=C1)C)NC(=S)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCCC4

Isomeric SMILES

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

InChI

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