(2R)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(2-methylquinazolin-4-yl)sulfanyl-propan-1-one

Systemtic Name: (2R)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(2-methylquinazolin-4-yl)sulfanyl-propan-1-one Openeye Name: (2R)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(2-methylquinazolin-4-yl)sulfanyl-propan-1-one CAS Name: (2R)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(2-methyl-4-quinazolinyl)thio]-1-propanone IUPAC Name: (2R)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(2-methylquinazolin-4-yl)sulfanylpropan-1-one Traditional Name: (2R)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(2-methylquinazolin-4-yl)thio]propan-1-one Formula: C21H21N3OS MolecularWeight: 363.47594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=N1)SC(C)C(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=N1)S[C@H](C)C(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C21H21N3OS/c1-14(21(25)24-12-11-16-7-3-4-8-17(16)13-24)26-20-18-9-5-6-10-19(18)22-15(2)23-20/h3-10,14H,11-13H2,1-2H3/t14-/m1/s1