6-(1H-benzimidazol-2-ylsulfanylmethyl)-N-(3-methylphenyl)quinazolin-4-amine

Systemtic Name: 6-(1H-benzimidazol-2-ylsulfanylmethyl)-N-(3-methylphenyl)quinazolin-4-amine Openeye Name: 6-(1H-benzimidazol-2-ylsulfanylmethyl)-N-(m-tolyl)quinazolin-4-amine CAS Name: 6-[(1H-benzimidazol-2-ylthio)methyl]-N-(3-methylphenyl)-4-quinazolinamine IUPAC Name: 6-(1H-benzimidazol-2-ylsulfanylmethyl)-N-(3-methylphenyl)quinazolin-4-amine Traditional Name: [6-[(1H-benzimidazol-2-ylthio)methyl]quinazolin-4-yl]-(m-tolyl)amine Formula: C23H19N5S MolecularWeight: 397.49546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC=NC3=C2C=C(C=C3)CSC4=NC5=CC=CC=C5N4

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC=NC3=C2C=C(C=C3)CSC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C23H19N5S/c1-15-5-4-6-17(11-15)26-22-18-12-16(9-10-19(18)24-14-25-22)13-29-23-27-20-7-2-3-8-21(20)28-23/h2-12,14H,13H2,1H3,(H,27,28)(H,24,25,26)