5-[3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenyl]-N-oxidanyl-thiophene-2-carboxamide

Systemtic Name: 5-[3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenyl]-N-oxidanyl-thiophene-2-carboxamide Openeye Name: 5-[3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenyl]thiophene-2-carbohydroxamic acid CAS Name: 5-[3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenyl]-N-hydroxy-2-thiophenecarboxamide IUPAC Name: 5-[3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenyl]-N-hydroxythiophene-2-carboxamide Traditional Name: 5-[3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenyl]thiophene-2-carbohydroxamic acid Formula: C21H20N2O2S MolecularWeight: 364.4607

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CC3=CC=CC(=C3)C4=CC=C(S4)C(=O)NO

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CC3=CC=CC(=C3)C4=CC=C(S4)C(=O)NO

InChI

InChI=1S/C21H20N2O2S/c24-21(22-25)20-9-8-19(26-20)17-7-3-4-15(12-17)13-23-11-10-16-5-1-2-6-18(16)14-23/h1-9,12,25H,10-11,13-14H2,(H,22,24)