N-[4-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-1,3-thiazol-2-yl]-5-methyl-1,2-oxazole-3-carboxamide

Systemtic Name: N-[4-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-1,3-thiazol-2-yl]-5-methyl-1,2-oxazole-3-carboxamide Openeye Name: N-[4-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)thiazol-2-yl]-5-methyl-isoxazole-3-carboxamide CAS Name: N-[4-(2,5-dimethyl-1-phenethyl-3-pyrrolyl)-2-thiazolyl]-5-methyl-3-isoxazolecarboxamide IUPAC Name: N-[4-(2,5-dimethyl-1-phenethylpyrrol-3-yl)-1,3-thiazol-2-yl]-5-methyl-1,2-oxazole-3-carboxamide Traditional Name: N-[4-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)thiazol-2-yl]-5-methyl-isoxazole-3-carboxamide Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCC2=CC=CC=C2)C)C3=CSC(=N3)NC(=O)C4=NOC(=C4)C

Isomeric SMILES

CC1=CC(=C(N1CCC2=CC=CC=C2)C)C3=CSC(=N3)NC(=O)C4=NOC(=C4)C

InChI

InChI=1S/C22H22N4O2S/c1-14-11-18(16(3)26(14)10-9-17-7-5-4-6-8-17)20-13-29-22(23-20)24-21(27)19-12-15(2)28-25-19/h4-8,11-13H,9-10H2,1-3H3,(H,23,24,27)