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

Systemtic Name: 1-(2,3-dimethylphenyl)-3-(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)thiourea Openeye Name: 1-(2,3-dimethylphenyl)-3-(2-methyl-5-morpholinosulfonyl-phenyl)thiourea CAS Name: 1-(2,3-dimethylphenyl)-3-[2-methyl-5-(4-morpholinylsulfonyl)phenyl]thiourea IUPAC Name: 1-(2,3-dimethylphenyl)-3-(2-methyl-5-morpholin-4-ylsulfonylphenyl)thiourea Traditional Name: 1-(2,3-dimethylphenyl)-3-(2-methyl-5-morpholinosulfonyl-phenyl)thiourea Formula: C20H25N3O3S2 MolecularWeight: 419.5608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O3S2/c1-14-5-4-6-18(16(14)3)21-20(27)22-19-13-17(8-7-15(19)2)28(24,25)23-9-11-26-12-10-23/h4-8,13H,9-12H2,1-3H3,(H2,21,22,27)