N-(3-ethynylphenyl)-6,7-di(propan-2-yloxy)-8aH-quinazolin-1-amine

Systemtic Name: N-(3-ethynylphenyl)-6,7-di(propan-2-yloxy)-8aH-quinazolin-1-amine Openeye Name: N-(3-ethynylphenyl)-6,7-diisopropoxy-8aH-quinazolin-1-amine CAS Name: N-(3-ethynylphenyl)-6,7-di(propan-2-yloxy)-8aH-quinazolin-1-amine IUPAC Name: N-(3-ethynylphenyl)-6,7-di(propan-2-yloxy)-8aH-quinazolin-1-amine Traditional Name: (6,7-diisopropoxy-8aH-quinazolin-1-yl)-(3-ethynylphenyl)amine Formula: C22H25N3O2 MolecularWeight: 363.4528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC2C(=CN=CN2NC3=CC=CC(=C3)C#C)C=C1OC(C)C

Isomeric SMILES

CC(C)OC1=CC2C(=CN=CN2NC3=CC=CC(=C3)C#C)C=C1OC(C)C

InChI

InChI=1S/C22H25N3O2/c1-6-17-8-7-9-19(10-17)24-25-14-23-13-18-11-21(26-15(2)3)22(12-20(18)25)27-16(4)5/h1,7-16,20,24H,2-5H3