N-[4-(2,5-dimethylthiophen-3-yl)-1,3-thiazol-2-yl]-2-[(1R)-2-ethanoyl-1H-isoquinolin-1-yl]ethanamide

Systemtic Name: N-[4-(2,5-dimethylthiophen-3-yl)-1,3-thiazol-2-yl]-2-[(1R)-2-ethanoyl-1H-isoquinolin-1-yl]ethanamide Openeye Name: 2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]-N-[4-(2,5-dimethyl-3-thienyl)thiazol-2-yl]acetamide CAS Name: 2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]-N-[4-(2,5-dimethyl-3-thiophenyl)-2-thiazolyl]acetamide IUPAC Name: 2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]-N-[4-(2,5-dimethylthiophen-3-yl)-1,3-thiazol-2-yl]acetamide Traditional Name: 2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]-N-[4-(2,5-dimethyl-3-thienyl)thiazol-2-yl]acetamide Formula: C22H21N3O2S2 MolecularWeight: 423.55104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C2=CSC(=N2)NC(=O)CC3C4=CC=CC=C4C=CN3C(=O)C

Isomeric SMILES

CC1=CC(=C(S1)C)C2=CSC(=N2)NC(=O)C[C@@H]3C4=CC=CC=C4C=CN3C(=O)C

InChI

InChI=1S/C22H21N3O2S2/c1-13-10-18(14(2)29-13)19-12-28-22(23-19)24-21(27)11-20-17-7-5-4-6-16(17)8-9-25(20)15(3)26/h4-10,12,20H,11H2,1-3H3,(H,23,24,27)/t20-/m1/s1