2-[1-[7-chloranyl-4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]propyl-prop-2-enoyl-amino]ethylcarbamic acid

Systemtic Name: 2-[1-[7-chloranyl-4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]propyl-prop-2-enoyl-amino]ethylcarbamic acid Openeye Name: 2-[1-(3-benzyl-7-chloro-4-oxo-quinazolin-2-yl)propyl-prop-2-enoyl-amino]ethylcarbamic acid CAS Name: 2-[1-[7-chloro-4-oxo-3-(phenylmethyl)-2-quinazolinyl]propyl-(1-oxoprop-2-enyl)amino]ethylcarbamic acid IUPAC Name: 2-[1-(3-benzyl-7-chloro-4-oxoquinazolin-2-yl)propyl-prop-2-enoylamino]ethylcarbamic acid Traditional Name: 2-[acryloyl-[1-(3-benzyl-7-chloro-4-keto-quinazolin-2-yl)propyl]amino]ethylcarbamic acid Formula: C24H25ClN4O4 MolecularWeight: 468.9327

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=C(C=CC(=C2)Cl)C(=O)N1CC3=CC=CC=C3)N(CCNC(=O)O)C(=O)C=C

Isomeric SMILES

CCC(C1=NC2=C(C=CC(=C2)Cl)C(=O)N1CC3=CC=CC=C3)N(CCNC(=O)O)C(=O)C=C

InChI

InChI=1S/C24H25ClN4O4/c1-3-20(28(21(30)4-2)13-12-26-24(32)33)22-27-19-14-17(25)10-11-18(19)23(31)29(22)15-16-8-6-5-7-9-16/h4-11,14,20,26H,2-3,12-13,15H2,1H3,(H,32,33)