N-[6,7-dimethoxy-2-[4-[(E)-pent-2-enoyl]piperazin-1-yl]quinazolin-4-yl]-1-(2-methylpropanoyl)pyrrolidine-2-carboxamide

Systemtic Name: N-[6,7-dimethoxy-2-[4-[(E)-pent-2-enoyl]piperazin-1-yl]quinazolin-4-yl]-1-(2-methylpropanoyl)pyrrolidine-2-carboxamide Openeye Name: N-[6,7-dimethoxy-2-[4-[(E)-pent-2-enoyl]piperazin-1-yl]quinazolin-4-yl]-1-(2-methylpropanoyl)pyrrolidine-2-carboxamide CAS Name: N-[6,7-dimethoxy-2-[4-[(E)-1-oxopent-2-enyl]-1-piperazinyl]-4-quinazolinyl]-1-(2-methyl-1-oxopropyl)-2-pyrrolidinecarboxamide IUPAC Name: N-[6,7-dimethoxy-2-[4-[(E)-pent-2-enoyl]piperazin-1-yl]quinazolin-4-yl]-1-(2-methylpropanoyl)pyrrolidine-2-carboxamide Traditional Name: N-[6,7-dimethoxy-2-[4-[(E)-pent-2-enoyl]piperazino]quinazolin-4-yl]-1-isobutyryl-pyrrolidine-2-carboxamide Formula: C28H38N6O5 MolecularWeight: 538.63852

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CC(=O)N1CCN(CC1)C2=NC3=CC(=C(C=C3C(=N2)NC(=O)C4CCCN4C(=O)C(C)C)OC)OC

Isomeric SMILES

CC/C=C/C(=O)N1CCN(CC1)C2=NC3=CC(=C(C=C3C(=N2)NC(=O)C4CCCN4C(=O)C(C)C)OC)OC

InChI

InChI=1S/C28H38N6O5/c1-6-7-10-24(35)32-12-14-33(15-13-32)28-29-20-17-23(39-5)22(38-4)16-19(20)25(31-28)30-26(36)21-9-8-11-34(21)27(37)18(2)3/h7,10,16-18,21H,6,8-9,11-15H2,1-5H3,(H,29,30,31,36)/b10-7+