ethyl 2-[2-[2-(2-ethanoyl-1H-isoquinolin-1-yl)ethanoylamino]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[2-(2-ethanoyl-1H-isoquinolin-1-yl)ethanoylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[[2-(2-acetyl-1H-isoquinolin-1-yl)acetyl]amino]thiazol-4-yl]acetate CAS Name: 2-[2-[[2-(2-acetyl-1H-isoquinolin-1-yl)-1-oxoethyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[[2-(2-acetyl-1H-isoquinolin-1-yl)acetyl]amino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[[2-(2-acetyl-1H-isoquinolin-1-yl)acetyl]amino]thiazol-4-yl]acetic acid ethyl ester Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)NC(=O)CC2C3=CC=CC=C3C=CN2C(=O)C

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)NC(=O)CC2C3=CC=CC=C3C=CN2C(=O)C

InChI

InChI=1S/C20H21N3O4S/c1-3-27-19(26)10-15-12-28-20(21-15)22-18(25)11-17-16-7-5-4-6-14(16)8-9-23(17)13(2)24/h4-9,12,17H,3,10-11H2,1-2H3,(H,21,22,25)