N-(2,5-dimethylphenyl)-3-[2-(phenylcarbamoylamino)-1,3-thiazol-4-yl]propanamide

Systemtic Name: N-(2,5-dimethylphenyl)-3-[2-(phenylcarbamoylamino)-1,3-thiazol-4-yl]propanamide Openeye Name: N-(2,5-dimethylphenyl)-3-[2-(phenylcarbamoylamino)thiazol-4-yl]propanamide CAS Name: 3-[2-[[anilino(oxo)methyl]amino]-4-thiazolyl]-N-(2,5-dimethylphenyl)propanamide IUPAC Name: N-(2,5-dimethylphenyl)-3-[2-(phenylcarbamoylamino)-1,3-thiazol-4-yl]propanamide Traditional Name: N-(2,5-dimethylphenyl)-3-[2-(phenylcarbamoylamino)thiazol-4-yl]propionamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)CCC2=CSC(=N2)NC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)CCC2=CSC(=N2)NC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H22N4O2S/c1-14-8-9-15(2)18(12-14)24-19(26)11-10-17-13-28-21(23-17)25-20(27)22-16-6-4-3-5-7-16/h3-9,12-13H,10-11H2,1-2H3,(H,24,26)(H2,22,23,25,27)