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

Systemtic Name: N-[3-[cyclohexyl-[(E)-3-phenylprop-2-enoyl]amino]propyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide Openeye Name: N-[3-[cyclohexyl-[(E)-3-phenylprop-2-enoyl]amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide CAS Name: N-[3-[cyclohexyl-[(E)-1-oxo-3-phenylprop-2-enyl]amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide IUPAC Name: N-[3-[cyclohexyl-[(E)-3-phenylprop-2-enoyl]amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide Traditional Name: N-[3-[cyclohexyl-[(E)-3-phenylacryloyl]amino]propyl]-4-keto-1H-quinazoline-2-carboxamide Formula: C27H30N4O3 MolecularWeight: 458.5521

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(CCCNC(=O)C2=NC(=O)C3=CC=CC=C3N2)C(=O)C=CC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)N(CCCNC(=O)C2=NC(=O)C3=CC=CC=C3N2)C(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C27H30N4O3/c32-24(17-16-20-10-3-1-4-11-20)31(21-12-5-2-6-13-21)19-9-18-28-27(34)25-29-23-15-8-7-14-22(23)26(33)30-25/h1,3-4,7-8,10-11,14-17,21H,2,5-6,9,12-13,18-19H2,(H,28,34)(H,29,30,33)/b17-16+