N-[1,1-bis(oxidanylidene)-1-benzothiophen-6-yl]-6-chloranyl-4-phenyl-quinazolin-2-amine

Systemtic Name: N-[1,1-bis(oxidanylidene)-1-benzothiophen-6-yl]-6-chloranyl-4-phenyl-quinazolin-2-amine Openeye Name: 6-chloro-N-(1,1-dioxobenzothiophen-6-yl)-4-phenyl-quinazolin-2-amine CAS Name: 6-chloro-N-(1,1-dioxo-1-benzothiophen-6-yl)-4-phenyl-2-quinazolinamine IUPAC Name: 6-chloro-N-(1,1-dioxo-1-benzothiophen-6-yl)-4-phenylquinazolin-2-amine Traditional Name: (6-chloro-4-phenyl-quinazolin-2-yl)-(1,1-diketobenzothiophen-6-yl)amine Formula: C22H14ClN3O2S MolecularWeight: 419.88346

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)Cl)NC4=CC5=C(C=C4)C=CS5(=O)=O

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)Cl)NC4=CC5=C(C=C4)C=CS5(=O)=O

InChI

InChI=1S/C22H14ClN3O2S/c23-16-7-9-19-18(12-16)21(15-4-2-1-3-5-15)26-22(25-19)24-17-8-6-14-10-11-29(27,28)20(14)13-17/h1-13H,(H,24,25,26)