2-[2-(3-methyl-1-oxidanylidene-isoquinolin-2-yl)ethanoylamino]-N-(5-methyl-1,3,4-thiadiazol-2-yl)ethanamide

Systemtic Name: 2-[2-(3-methyl-1-oxidanylidene-isoquinolin-2-yl)ethanoylamino]-N-(5-methyl-1,3,4-thiadiazol-2-yl)ethanamide Openeye Name: 2-[[2-(3-methyl-1-oxo-2-isoquinolyl)acetyl]amino]-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide CAS Name: 2-[[2-(3-methyl-1-oxo-2-isoquinolinyl)-1-oxoethyl]amino]-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide IUPAC Name: 2-[[2-(3-methyl-1-oxoisoquinolin-2-yl)acetyl]amino]-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide Traditional Name: 2-[[2-(1-keto-3-methyl-2-isoquinolyl)acetyl]amino]-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide Formula: C17H17N5O3S MolecularWeight: 371.41358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC=CC=C2C(=O)N1CC(=O)NCC(=O)NC3=NN=C(S3)C

Isomeric SMILES

CC1=CC2=CC=CC=C2C(=O)N1CC(=O)NCC(=O)NC3=NN=C(S3)C

InChI

InChI=1S/C17H17N5O3S/c1-10-7-12-5-3-4-6-13(12)16(25)22(10)9-15(24)18-8-14(23)19-17-21-20-11(2)26-17/h3-7H,8-9H2,1-2H3,(H,18,24)(H,19,21,23)