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

Systemtic Name: 1-(3,5-dimethylphenyl)-3-(4-methoxy-2-morpholin-4-ylsulfonyl-phenyl)thiourea Openeye Name: 1-(3,5-dimethylphenyl)-3-(4-methoxy-2-morpholinosulfonyl-phenyl)thiourea CAS Name: 1-(3,5-dimethylphenyl)-3-[4-methoxy-2-(4-morpholinylsulfonyl)phenyl]thiourea IUPAC Name: 1-(3,5-dimethylphenyl)-3-(4-methoxy-2-morpholin-4-ylsulfonylphenyl)thiourea Traditional Name: 1-(3,5-dimethylphenyl)-3-(4-methoxy-2-morpholinosulfonyl-phenyl)thiourea Formula: C20H25N3O4S2 MolecularWeight: 435.5602

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O4S2/c1-14-10-15(2)12-16(11-14)21-20(28)22-18-5-4-17(26-3)13-19(18)29(24,25)23-6-8-27-9-7-23/h4-5,10-13H,6-9H2,1-3H3,(H2,21,22,28)