N-[4-[(4-tert-butylphenyl)amino]quinazolin-6-yl]prop-2-enamide

Systemtic Name: N-[4-[(4-tert-butylphenyl)amino]quinazolin-6-yl]prop-2-enamide Openeye Name: N-[4-(4-tert-butylanilino)quinazolin-6-yl]prop-2-enamide CAS Name: N-[4-(4-tert-butylanilino)-6-quinazolinyl]-2-propenamide IUPAC Name: N-[4-(4-tert-butylanilino)quinazolin-6-yl]prop-2-enamide Traditional Name: N-[4-(4-tert-butylanilino)quinazolin-6-yl]acrylamide Formula: C21H22N4O MolecularWeight: 346.42558

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC2=NC=NC3=C2C=C(C=C3)NC(=O)C=C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC2=NC=NC3=C2C=C(C=C3)NC(=O)C=C

InChI

InChI=1S/C21H22N4O/c1-5-19(26)24-16-10-11-18-17(12-16)20(23-13-22-18)25-15-8-6-14(7-9-15)21(2,3)4/h5-13H,1H2,2-4H3,(H,24,26)(H,22,23,25)