N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxidanylidene-butyl]thiophene-3-carboxamide

Systemtic Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxidanylidene-butyl]thiophene-3-carboxamide Openeye Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxo-butyl]thiophene-3-carboxamide CAS Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxobutyl]-3-thiophenecarboxamide IUPAC Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxobutyl]thiophene-3-carboxamide Traditional Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-keto-butyl]thiophene-3-carboxamide Formula: C18H20N2O2S MolecularWeight: 328.4286

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)CCCNC(=O)C3=CSC=C3

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)CCCNC(=O)C3=CSC=C3

InChI

InChI=1S/C18H20N2O2S/c21-17(6-3-9-19-18(22)16-8-11-23-13-16)20-10-7-14-4-1-2-5-15(14)12-20/h1-2,4-5,8,11,13H,3,6-7,9-10,12H2,(H,19,22)