(4-azanylquinazolin-2-yl)methyl 6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: (4-azanylquinazolin-2-yl)methyl 6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: (4-aminoquinazolin-2-yl)methyl 6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid (4-amino-2-quinazolinyl)methyl ester IUPAC Name: (4-aminoquinazolin-2-yl)methyl 6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid (4-aminoquinazolin-2-yl)methyl ester Formula: C19H19N3O2S MolecularWeight: 353.43806

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC=C2C(=O)OCC3=NC4=CC=CC=C4C(=N3)N

Isomeric SMILES

CC1CCC2=C(C1)SC=C2C(=O)OCC3=NC4=CC=CC=C4C(=N3)N

InChI

InChI=1S/C19H19N3O2S/c1-11-6-7-12-14(10-25-16(12)8-11)19(23)24-9-17-21-15-5-3-2-4-13(15)18(20)22-17/h2-5,10-11H,6-9H2,1H3,(H2,20,21,22)