N-(1-ethylpiperidin-3-yl)-6-iodanyl-2-(4-methoxyphenyl)quinazolin-4-amine

Systemtic Name: N-(1-ethylpiperidin-3-yl)-6-iodanyl-2-(4-methoxyphenyl)quinazolin-4-amine Openeye Name: N-(1-ethyl-3-piperidyl)-6-iodo-2-(4-methoxyphenyl)quinazolin-4-amine CAS Name: N-(1-ethyl-3-piperidinyl)-6-iodo-2-(4-methoxyphenyl)-4-quinazolinamine IUPAC Name: N-(1-ethylpiperidin-3-yl)-6-iodo-2-(4-methoxyphenyl)quinazolin-4-amine Traditional Name: (1-ethyl-3-piperidyl)-[6-iodo-2-(4-methoxyphenyl)quinazolin-4-yl]amine Formula: C22H25IN4O MolecularWeight: 488.36457

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC(C1)NC2=NC(=NC3=C2C=C(C=C3)I)C4=CC=C(C=C4)OC

Isomeric SMILES

CCN1CCCC(C1)NC2=NC(=NC3=C2C=C(C=C3)I)C4=CC=C(C=C4)OC

InChI

InChI=1S/C22H25IN4O/c1-3-27-12-4-5-17(14-27)24-22-19-13-16(23)8-11-20(19)25-21(26-22)15-6-9-18(28-2)10-7-15/h6-11,13,17H,3-5,12,14H2,1-2H3,(H,24,25,26)