N-[4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1,3-thiazol-2-yl]-2-phenoxy-propanamide

Systemtic Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1,3-thiazol-2-yl]-2-phenoxy-propanamide Openeye Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)thiazol-2-yl]-2-phenoxy-propanamide CAS Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-thiazolyl]-2-phenoxypropanamide IUPAC Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1,3-thiazol-2-yl]-2-phenoxypropanamide Traditional Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)thiazol-2-yl]-2-phenoxy-propionamide Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC(=CS1)CN2CCC3=CC=CC=C3C2)OC4=CC=CC=C4

Isomeric SMILES

CC(C(=O)NC1=NC(=CS1)CN2CCC3=CC=CC=C3C2)OC4=CC=CC=C4

InChI

InChI=1S/C22H23N3O2S/c1-16(27-20-9-3-2-4-10-20)21(26)24-22-23-19(15-28-22)14-25-12-11-17-7-5-6-8-18(17)13-25/h2-10,15-16H,11-14H2,1H3,(H,23,24,26)