(3R)-2-ethanoyl-N-(6-methyl-1,3-benzothiazol-2-yl)-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: (3R)-2-ethanoyl-N-(6-methyl-1,3-benzothiazol-2-yl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: (3R)-2-acetyl-N-(6-methyl-1,3-benzothiazol-2-yl)-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: (3R)-2-acetyl-N-(6-methyl-1,3-benzothiazol-2-yl)-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: (3R)-2-acetyl-N-(6-methyl-1,3-benzothiazol-2-yl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: (3R)-2-acetyl-N-(6-methyl-1,3-benzothiazol-2-yl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C20H19N3O2S MolecularWeight: 365.44876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CC4=CC=CC=C4CN3C(=O)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)[C@H]3CC4=CC=CC=C4CN3C(=O)C

InChI

InChI=1S/C20H19N3O2S/c1-12-7-8-16-18(9-12)26-20(21-16)22-19(25)17-10-14-5-3-4-6-15(14)11-23(17)13(2)24/h3-9,17H,10-11H2,1-2H3,(H,21,22,25)/t17-/m1/s1