2-[[5-chloranyl-1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylmethyl]quinazolin-4-amine

Systemtic Name: 2-[[5-chloranyl-1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylmethyl]quinazolin-4-amine Openeye Name: 2-[[5-chloro-1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylmethyl]quinazolin-4-amine CAS Name: 2-[[[5-chloro-1-(2-methoxyethyl)-2-benzimidazolyl]thio]methyl]-4-quinazolinamine IUPAC Name: 2-[[5-chloro-1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylmethyl]quinazolin-4-amine Traditional Name: [2-[[[5-chloro-1-(2-methoxyethyl)benzimidazol-2-yl]thio]methyl]quinazolin-4-yl]amine Formula: C19H18ClN5OS MolecularWeight: 399.89712

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C2=C(C=C(C=C2)Cl)N=C1SCC3=NC4=CC=CC=C4C(=N3)N

Isomeric SMILES

COCCN1C2=C(C=C(C=C2)Cl)N=C1SCC3=NC4=CC=CC=C4C(=N3)N

InChI

InChI=1S/C19H18ClN5OS/c1-26-9-8-25-16-7-6-12(20)10-15(16)23-19(25)27-11-17-22-14-5-3-2-4-13(14)18(21)24-17/h2-7,10H,8-9,11H2,1H3,(H2,21,22,24)