3-phenyl-N-[(5S)-2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-yl]prop-2-ynamide

Systemtic Name: 3-phenyl-N-[(5S)-2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-yl]prop-2-ynamide Openeye Name: 3-phenyl-N-[(5S)-2-(3-pyridyl)-5,6,7,8-tetrahydroquinazolin-5-yl]prop-2-ynamide CAS Name: 3-phenyl-N-[(5S)-2-(3-pyridinyl)-5,6,7,8-tetrahydroquinazolin-5-yl]-2-propynamide IUPAC Name: 3-phenyl-N-[(5S)-2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-yl]prop-2-ynamide Traditional Name: 3-phenyl-N-[(5S)-2-(3-pyridyl)-5,6,7,8-tetrahydroquinazolin-5-yl]propiolamide Formula: C22H18N4O MolecularWeight: 354.40452

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=CN=C(N=C2C1)C3=CN=CC=C3)NC(=O)C#CC4=CC=CC=C4

Isomeric SMILES

C1C[C@@H](C2=CN=C(N=C2C1)C3=CN=CC=C3)NC(=O)C#CC4=CC=CC=C4

InChI

InChI=1S/C22H18N4O/c27-21(12-11-16-6-2-1-3-7-16)25-19-9-4-10-20-18(19)15-24-22(26-20)17-8-5-13-23-14-17/h1-3,5-8,13-15,19H,4,9-10H2,(H,25,27)/t19-/m0/s1