4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(1,3,4-thiadiazol-2-yl)benzamide

Systemtic Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(1,3,4-thiadiazol-2-yl)benzamide Openeye Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(1,3,4-thiadiazol-2-yl)benzamide CAS Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(1,3,4-thiadiazol-2-yl)benzamide IUPAC Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(1,3,4-thiadiazol-2-yl)benzamide Traditional Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(1,3,4-thiadiazol-2-yl)benzamide Formula: C18H16N4O3S2 MolecularWeight: 400.47464

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)C(=O)NC4=NN=CS4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)C(=O)NC4=NN=CS4

InChI

InChI=1S/C18H16N4O3S2/c23-17(20-18-21-19-12-26-18)14-5-7-16(8-6-14)27(24,25)22-10-9-13-3-1-2-4-15(13)11-22/h1-8,12H,9-11H2,(H,20,21,23)