N-phenethyl-2-pyridin-3-yl-quinazolin-4-amine dichloride

Systemtic Name: N-phenethyl-2-pyridin-3-yl-quinazolin-4-amine dichloride Openeye Name: N-phenethyl-2-(3-pyridyl)quinazolin-4-amine dichloride CAS Name: N-phenethyl-2-(3-pyridinyl)-4-quinazolinamine dichloride IUPAC Name: N-phenethyl-2-pyridin-3-ylquinazolin-4-amine dichloride Traditional Name: phenethyl-[2-(3-pyridyl)quinazolin-4-yl]amine dichloride Formula: C21H18Cl2N4-2 MolecularWeight: 397.30042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC2=NC(=NC3=CC=CC=C32)C4=CN=CC=C4.[Cl-].[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)CCNC2=NC(=NC3=CC=CC=C32)C4=CN=CC=C4.[Cl-].[Cl-]

InChI

InChI=1S/C21H18N4.2ClH/c1-2-7-16(8-3-1)12-14-23-21-18-10-4-5-11-19(18)24-20(25-21)17-9-6-13-22-15-17;;/h1-11,13,15H,12,14H2,(H,23,24,25);2*1H/p-2