2-[isoquinolin-5-ylsulfonyl(propyl)amino]-N-(5-methyl-1,3,4-thiadiazol-2-yl)ethanamide

Systemtic Name: 2-[isoquinolin-5-ylsulfonyl(propyl)amino]-N-(5-methyl-1,3,4-thiadiazol-2-yl)ethanamide Openeye Name: 2-[5-isoquinolylsulfonyl(propyl)amino]-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide CAS Name: 2-[5-isoquinolinylsulfonyl(propyl)amino]-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide IUPAC Name: 2-[isoquinolin-5-ylsulfonyl(propyl)amino]-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide Traditional Name: 2-[5-isoquinolylsulfonyl(propyl)amino]-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide Formula: C17H19N5O3S2 MolecularWeight: 405.49446

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)NC1=NN=C(S1)C)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

Isomeric SMILES

CCCN(CC(=O)NC1=NN=C(S1)C)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C17H19N5O3S2/c1-3-9-22(11-16(23)19-17-21-20-12(2)26-17)27(24,25)15-6-4-5-13-10-18-8-7-14(13)15/h4-8,10H,3,9,11H2,1-2H3,(H,19,21,23)