3-(2,6-dimethylphenyl)-1-(2-methoxyethyl)-1-[(4-pyrrolidin-1-ylcarbonyl-1,3-thiazol-2-yl)methyl]urea

Systemtic Name: 3-(2,6-dimethylphenyl)-1-(2-methoxyethyl)-1-[(4-pyrrolidin-1-ylcarbonyl-1,3-thiazol-2-yl)methyl]urea Openeye Name: 3-(2,6-dimethylphenyl)-1-(2-methoxyethyl)-1-[[4-(pyrrolidine-1-carbonyl)thiazol-2-yl]methyl]urea CAS Name: 3-(2,6-dimethylphenyl)-1-(2-methoxyethyl)-1-[[4-[oxo(1-pyrrolidinyl)methyl]-2-thiazolyl]methyl]urea IUPAC Name: 3-(2,6-dimethylphenyl)-1-(2-methoxyethyl)-1-[[4-(pyrrolidine-1-carbonyl)-1,3-thiazol-2-yl]methyl]urea Traditional Name: 3-(2,6-dimethylphenyl)-1-(2-methoxyethyl)-1-[[4-(pyrrolidine-1-carbonyl)thiazol-2-yl]methyl]urea Formula: C21H28N4O3S MolecularWeight: 416.53702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)N(CCOC)CC2=NC(=CS2)C(=O)N3CCCC3

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)N(CCOC)CC2=NC(=CS2)C(=O)N3CCCC3

InChI

InChI=1S/C21H28N4O3S/c1-15-7-6-8-16(2)19(15)23-21(27)25(11-12-28-3)13-18-22-17(14-29-18)20(26)24-9-4-5-10-24/h6-8,14H,4-5,9-13H2,1-3H3,(H,23,27)