5-(5-cyclopropyl-1H-pyrazol-3-yl)-2-(3-methylphenyl)sulfanyl-quinazolin-4-amine

Systemtic Name: 5-(5-cyclopropyl-1H-pyrazol-3-yl)-2-(3-methylphenyl)sulfanyl-quinazolin-4-amine Openeye Name: 5-(5-cyclopropyl-1H-pyrazol-3-yl)-2-(m-tolylsulfanyl)quinazolin-4-amine CAS Name: 5-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[(3-methylphenyl)thio]-4-quinazolinamine IUPAC Name: 5-(5-cyclopropyl-1H-pyrazol-3-yl)-2-(3-methylphenyl)sulfanylquinazolin-4-amine Traditional Name: [5-(5-cyclopropyl-1H-pyrazol-3-yl)-2-(m-tolylthio)quinazolin-4-yl]amine Formula: C21H19N5S MolecularWeight: 373.47406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)SC2=NC3=CC=CC(=C3C(=N2)N)C4=NNC(=C4)C5CC5

Isomeric SMILES

CC1=CC(=CC=C1)SC2=NC3=CC=CC(=C3C(=N2)N)C4=NNC(=C4)C5CC5

InChI

InChI=1S/C21H19N5S/c1-12-4-2-5-14(10-12)27-21-23-16-7-3-6-15(19(16)20(22)24-21)18-11-17(25-26-18)13-8-9-13/h2-7,10-11,13H,8-9H2,1H3,(H,25,26)(H2,22,23,24)