2-[3-[(2-methyl-1,3-thiazol-4-yl)methoxy]phenyl]carbonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-[3-[(2-methyl-1,3-thiazol-4-yl)methoxy]phenyl]carbonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-[3-[(2-methylthiazol-4-yl)methoxy]benzoyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-[[3-[(2-methyl-4-thiazolyl)methoxy]phenyl]-oxomethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-[3-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-[3-[(2-methylthiazol-4-yl)methoxy]benzoyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)COC2=CC=CC(=C2)C(=O)N3CC4=CC=CC=C4CC3C(=O)N

Isomeric SMILES

CC1=NC(=CS1)COC2=CC=CC(=C2)C(=O)N3CC4=CC=CC=C4CC3C(=O)N

InChI

InChI=1S/C22H21N3O3S/c1-14-24-18(13-29-14)12-28-19-8-4-7-16(9-19)22(27)25-11-17-6-3-2-5-15(17)10-20(25)21(23)26/h2-9,13,20H,10-12H2,1H3,(H2,23,26)