3-[4-(thiophen-2-ylmethylamino)quinazolin-6-yl]benzenecarbonitrile

Systemtic Name: 3-[4-(thiophen-2-ylmethylamino)quinazolin-6-yl]benzenecarbonitrile Openeye Name: 3-[4-(2-thienylmethylamino)quinazolin-6-yl]benzonitrile CAS Name: 3-[4-(thiophen-2-ylmethylamino)-6-quinazolinyl]benzonitrile IUPAC Name: 3-[4-(thiophen-2-ylmethylamino)quinazolin-6-yl]benzonitrile Traditional Name: 3-[4-(2-thenylamino)quinazolin-6-yl]benzonitrile Formula: C20H14N4S MolecularWeight: 342.41696

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C2=CC3=C(C=C2)N=CN=C3NCC4=CC=CS4)C#N

Isomeric SMILES

C1=CC(=CC(=C1)C2=CC3=C(C=C2)N=CN=C3NCC4=CC=CS4)C#N

InChI

InChI=1S/C20H14N4S/c21-11-14-3-1-4-15(9-14)16-6-7-19-18(10-16)20(24-13-23-19)22-12-17-5-2-8-25-17/h1-10,13H,12H2,(H,22,23,24)