N-[4-(2-azanyl-2-oxidanylidene-ethyl)-1,3-thiazol-2-yl]-2-(2-ethanoyl-1H-isoquinolin-1-yl)ethanamide

Systemtic Name: N-[4-(2-azanyl-2-oxidanylidene-ethyl)-1,3-thiazol-2-yl]-2-(2-ethanoyl-1H-isoquinolin-1-yl)ethanamide Openeye Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[4-(2-amino-2-oxo-ethyl)thiazol-2-yl]acetamide CAS Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[4-(2-amino-2-oxoethyl)-2-thiazolyl]acetamide IUPAC Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[4-(2-amino-2-oxoethyl)-1,3-thiazol-2-yl]acetamide Traditional Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[4-(2-amino-2-keto-ethyl)thiazol-2-yl]acetamide Formula: C18H18N4O3S MolecularWeight: 370.42552

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C=CC2=CC=CC=C2C1CC(=O)NC3=NC(=CS3)CC(=O)N

Isomeric SMILES

CC(=O)N1C=CC2=CC=CC=C2C1CC(=O)NC3=NC(=CS3)CC(=O)N

InChI

InChI=1S/C18H18N4O3S/c1-11(23)22-7-6-12-4-2-3-5-14(12)15(22)9-17(25)21-18-20-13(10-26-18)8-16(19)24/h2-7,10,15H,8-9H2,1H3,(H2,19,24)(H,20,21,25)