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

Systemtic Name: N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-(3-methoxyphenyl)sulfanyl-quinazolin-4-amine Openeye Name: N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-(3-methoxyphenyl)sulfanyl-quinazolin-4-amine CAS Name: N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[(3-methoxyphenyl)thio]-4-quinazolinamine IUPAC Name: N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-(3-methoxyphenyl)sulfanylquinazolin-4-amine Traditional Name: (5-cyclopropyl-1H-pyrazol-3-yl)-[2-[(3-methoxyphenyl)thio]quinazolin-4-yl]amine Formula: C21H19N5OS MolecularWeight: 389.47346

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC=C1)SC2=NC3=CC=CC=C3C(=N2)NC4=NNC(=C4)C5CC5

Isomeric SMILES

COC1=CC(=CC=C1)SC2=NC3=CC=CC=C3C(=N2)NC4=NNC(=C4)C5CC5

InChI

InChI=1S/C21H19N5OS/c1-27-14-5-4-6-15(11-14)28-21-22-17-8-3-2-7-16(17)20(24-21)23-19-12-18(25-26-19)13-9-10-13/h2-8,11-13H,9-10H2,1H3,(H2,22,23,24,25,26)