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

Systemtic Name: N-[3-[[(E)-3-(4-chlorophenyl)prop-2-enoyl]amino]propyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide Openeye Name: N-[3-[[(E)-3-(4-chlorophenyl)prop-2-enoyl]amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide CAS Name: N-[3-[[(E)-3-(4-chlorophenyl)-1-oxoprop-2-enyl]amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide IUPAC Name: N-[3-[[(E)-3-(4-chlorophenyl)prop-2-enoyl]amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide Traditional Name: N-[3-[[(E)-3-(4-chlorophenyl)acryloyl]amino]propyl]-4-keto-1H-quinazoline-2-carboxamide Formula: C21H19ClN4O3 MolecularWeight: 410.85356

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)C(=O)NCCCNC(=O)C=CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)C(=O)NCCCNC(=O)/C=C/C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H19ClN4O3/c22-15-9-6-14(7-10-15)8-11-18(27)23-12-3-13-24-21(29)19-25-17-5-2-1-4-16(17)20(28)26-19/h1-2,4-11H,3,12-13H2,(H,23,27)(H,24,29)(H,25,26,28)/b11-8+