N-[2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]ethyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide

Systemtic Name: N-[2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]ethyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide Openeye Name: N-[2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]ethyl]-4-oxo-1H-quinazoline-2-carboxamide CAS Name: N-[2-[[(E)-3-(4-methoxyphenyl)-1-oxoprop-2-enyl]amino]ethyl]-4-oxo-1H-quinazoline-2-carboxamide IUPAC Name: N-[2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]ethyl]-4-oxo-1H-quinazoline-2-carboxamide Traditional Name: 4-keto-N-[2-[[(E)-3-(4-methoxyphenyl)acryloyl]amino]ethyl]-1H-quinazoline-2-carboxamide Formula: C21H20N4O4 MolecularWeight: 392.4079

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC(=O)NCCNC(=O)C2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C(=O)NCCNC(=O)C2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C21H20N4O4/c1-29-15-9-6-14(7-10-15)8-11-18(26)22-12-13-23-21(28)19-24-17-5-3-2-4-16(17)20(27)25-19/h2-11H,12-13H2,1H3,(H,22,26)(H,23,28)(H,24,25,27)/b11-8+