1-[(3-chlorophenyl)methyl]-2,4-bis(oxidanylidene)-N-(phenylmethyl)-3-prop-2-enyl-quinazoline-7-carboxamide

Systemtic Name: 1-[(3-chlorophenyl)methyl]-2,4-bis(oxidanylidene)-N-(phenylmethyl)-3-prop-2-enyl-quinazoline-7-carboxamide Openeye Name: 3-allyl-N-benzyl-1-[(3-chlorophenyl)methyl]-2,4-dioxo-quinazoline-7-carboxamide CAS Name: 1-[(3-chlorophenyl)methyl]-2,4-dioxo-N-(phenylmethyl)-3-prop-2-enyl-7-quinazolinecarboxamide IUPAC Name: N-benzyl-1-[(3-chlorophenyl)methyl]-2,4-dioxo-3-prop-2-enylquinazoline-7-carboxamide Traditional Name: 3-allyl-N-benzyl-1-(3-chlorobenzyl)-2,4-diketo-quinazoline-7-carboxamide Formula: C26H22ClN3O3 MolecularWeight: 459.92418

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3=CC=CC=C3)N(C1=O)CC4=CC(=CC=C4)Cl

Isomeric SMILES

C=CCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3=CC=CC=C3)N(C1=O)CC4=CC(=CC=C4)Cl

InChI

InChI=1S/C26H22ClN3O3/c1-2-13-29-25(32)22-12-11-20(24(31)28-16-18-7-4-3-5-8-18)15-23(22)30(26(29)33)17-19-9-6-10-21(27)14-19/h2-12,14-15H,1,13,16-17H2,(H,28,31)