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

Systemtic Name: [1-[7-chloranyl-4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]propyl-prop-2-enoyl-amino]-ethyl-carbamic acid Openeye Name: [1-(3-benzyl-7-chloro-4-oxo-quinazolin-2-yl)propyl-prop-2-enoyl-amino]-ethyl-carbamic acid CAS Name: [1-[7-chloro-4-oxo-3-(phenylmethyl)-2-quinazolinyl]propyl-(1-oxoprop-2-enyl)amino]-ethylcarbamic acid IUPAC Name: [1-(3-benzyl-7-chloro-4-oxoquinazolin-2-yl)propyl-prop-2-enoylamino]-ethylcarbamic acid Traditional Name: [acryloyl-[1-(3-benzyl-7-chloro-4-keto-quinazolin-2-yl)propyl]amino]-ethyl-carbamic 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(C(=O)C=C)N(CC)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C24H25ClN4O4/c1-4-20(29(21(30)5-2)28(6-3)24(32)33)22-26-19-14-17(25)12-13-18(19)23(31)27(22)15-16-10-8-7-9-11-16/h5,7-14,20H,2,4,6,15H2,1,3H3,(H,32,33)