N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]-2,4-bis(oxidanylidene)-3-phenyl-1H-quinazoline-7-carboxamide

Systemtic Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]-2,4-bis(oxidanylidene)-3-phenyl-1H-quinazoline-7-carboxamide Openeye Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]-2,4-dioxo-3-phenyl-1H-quinazoline-7-carboxamide CAS Name: N-[4-(4-ethyl-1-piperazin-4-iumyl)-2-methylphenyl]-2,4-dioxo-3-phenyl-1H-quinazoline-7-carboxamide IUPAC Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methylphenyl]-2,4-dioxo-3-phenyl-1H-quinazoline-7-carboxamide Traditional Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-2-methyl-phenyl]-2,4-diketo-3-phenyl-1H-quinazoline-7-carboxamide Formula: C28H30N5O3+ MolecularWeight: 484.5695

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC(=C(C=C2)NC(=O)C3=CC4=C(C=C3)C(=O)N(C(=O)N4)C5=CC=CC=C5)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC(=C(C=C2)NC(=O)C3=CC4=C(C=C3)C(=O)N(C(=O)N4)C5=CC=CC=C5)C

InChI

InChI=1S/C28H29N5O3/c1-3-31-13-15-32(16-14-31)22-10-12-24(19(2)17-22)29-26(34)20-9-11-23-25(18-20)30-28(36)33(27(23)35)21-7-5-4-6-8-21/h4-12,17-18H,3,13-16H2,1-2H3,(H,29,34)(H,30,36)/p+1