N-(4-butylphenyl)-2-chloranyl-quinazolin-4-amine

Systemtic Name: N-(4-butylphenyl)-2-chloranyl-quinazolin-4-amine Openeye Name: N-(4-butylphenyl)-2-chloro-quinazolin-4-amine CAS Name: N-(4-butylphenyl)-2-chloro-4-quinazolinamine IUPAC Name: N-(4-butylphenyl)-2-chloroquinazolin-4-amine Traditional Name: (4-butylphenyl)-(2-chloroquinazolin-4-yl)amine Formula: C18H18ClN3 MolecularWeight: 311.80862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C32)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C32)Cl

InChI

InChI=1S/C18H18ClN3/c1-2-3-6-13-9-11-14(12-10-13)20-17-15-7-4-5-8-16(15)21-18(19)22-17/h4-5,7-12H,2-3,6H2,1H3,(H,20,21,22)