6,7-diethoxy-N-(3-ethynyl-2-methyl-phenyl)-8aH-quinazolin-1-amine

Systemtic Name: 6,7-diethoxy-N-(3-ethynyl-2-methyl-phenyl)-8aH-quinazolin-1-amine Openeye Name: 6,7-diethoxy-N-(3-ethynyl-2-methyl-phenyl)-8aH-quinazolin-1-amine CAS Name: 6,7-diethoxy-N-(3-ethynyl-2-methylphenyl)-8aH-quinazolin-1-amine IUPAC Name: 6,7-diethoxy-N-(3-ethynyl-2-methylphenyl)-8aH-quinazolin-1-amine Traditional Name: (6,7-diethoxy-8aH-quinazolin-1-yl)-(3-ethynyl-2-methyl-phenyl)amine Formula: C21H23N3O2 MolecularWeight: 349.42622

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2C(=CN=CN2NC3=CC=CC(=C3C)C#C)C=C1OCC

Isomeric SMILES

CCOC1=CC2C(=CN=CN2NC3=CC=CC(=C3C)C#C)C=C1OCC

InChI

InChI=1S/C21H23N3O2/c1-5-16-9-8-10-18(15(16)4)23-24-14-22-13-17-11-20(25-6-2)21(26-7-3)12-19(17)24/h1,8-14,19,23H,6-7H2,2-4H3