N-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide

Systemtic Name: N-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: N-[[5-(1,3-benzothiazol-2-yl)-2-furyl]methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: N-[[5-(1,3-benzothiazol-2-yl)-2-furanyl]methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: N-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: N-[[5-(1,3-benzothiazol-2-yl)-2-furyl]methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C22H19N3O2S MolecularWeight: 389.47016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)NCC3=CC=C(O3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)NCC3=CC=C(O3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H19N3O2S/c26-22(25-12-11-15-5-1-2-6-16(15)14-25)23-13-17-9-10-19(27-17)21-24-18-7-3-4-8-20(18)28-21/h1-10H,11-14H2,(H,23,26)