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1-(3-aminophenyl)-4-(2-thiomorpholin-2-ylethyl)-2,4-dihydro-1H-isoquinolin-3-one

1-(3-aminophenyl)-4-(2-thiomorpholin-2-ylethyl)-2,4-dihydro-1H-isoquinolin-3-one

Systemtic Name:1-(3-aminophenyl)-4-(2-thiomorpholin-2-ylethyl)-2,4-dihydro-1H-isoquinolin-3-one
Openeye Name:1-(3-aminophenyl)-4-(2-thiomorpholin-2-ylethyl)-2,4-dihydro-1H-isoquinolin-3-one
CAS Name:1-(3-aminophenyl)-4-[2-(2-thiomorpholinyl)ethyl]-2,4-dihydro-1H-isoquinolin-3-one
IUPAC Name:1-(3-aminophenyl)-4-(2-thiomorpholin-2-ylethyl)-2,4-dihydro-1H-isoquinolin-3-one
Traditional Name:1-(3-aminophenyl)-4-(2-thiomorpholin-2-ylethyl)-2,4-dihydro-1H-isoquinolin-3-one
Formula: C21H25N3OS
MolecularWeight: 367.5077
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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(CN1)CCC2C3=CC=CC=C3C(NC2=O)C4=CC(=CC=C4)N


Isomeric SMILES

C1CSC(CN1)CCC2C3=CC=CC=C3C(NC2=O)C4=CC(=CC=C4)N


InChI

InChI=1S/C21H25N3OS/c22-15-5-3-4-14(12-15)20-18-7-2-1-6-17(18)19(21(25)24-20)9-8-16-13-23-10-11-26-16/h1-7,12,16,19-20,23H,8-11,13,22H2,(H,24,25)


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