1-(2,6-diethylphenyl)-3-(4-methyl-2-morpholin-4-ylsulfonyl-phenyl)thiourea

Systemtic Name: 1-(2,6-diethylphenyl)-3-(4-methyl-2-morpholin-4-ylsulfonyl-phenyl)thiourea Openeye Name: 1-(2,6-diethylphenyl)-3-(4-methyl-2-morpholinosulfonyl-phenyl)thiourea CAS Name: 1-(2,6-diethylphenyl)-3-[4-methyl-2-(4-morpholinylsulfonyl)phenyl]thiourea IUPAC Name: 1-(2,6-diethylphenyl)-3-(4-methyl-2-morpholin-4-ylsulfonylphenyl)thiourea Traditional Name: 1-(2,6-diethylphenyl)-3-(4-methyl-2-morpholinosulfonyl-phenyl)thiourea Formula: C22H29N3O3S2 MolecularWeight: 447.61396

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=S)NC2=C(C=C(C=C2)C)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=S)NC2=C(C=C(C=C2)C)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C22H29N3O3S2/c1-4-17-7-6-8-18(5-2)21(17)24-22(29)23-19-10-9-16(3)15-20(19)30(26,27)25-11-13-28-14-12-25/h6-10,15H,4-5,11-14H2,1-3H3,(H2,23,24,29)