4-[(3-methylphenyl)amino]-N-[(4-propan-2-yloxyphenyl)methyl]quinazoline-2-carboxamide

Systemtic Name: 4-[(3-methylphenyl)amino]-N-[(4-propan-2-yloxyphenyl)methyl]quinazoline-2-carboxamide Openeye Name: N-[(4-isopropoxyphenyl)methyl]-4-(3-methylanilino)quinazoline-2-carboxamide CAS Name: 4-(3-methylanilino)-N-[(4-propan-2-yloxyphenyl)methyl]-2-quinazolinecarboxamide IUPAC Name: 4-(3-methylanilino)-N-[(4-propan-2-yloxyphenyl)methyl]quinazoline-2-carboxamide Traditional Name: N-(4-isopropoxybenzyl)-4-(m-toluidino)quinazoline-2-carboxamide Formula: C26H26N4O2 MolecularWeight: 426.51024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC(=NC3=CC=CC=C32)C(=O)NCC4=CC=C(C=C4)OC(C)C

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC(=NC3=CC=CC=C32)C(=O)NCC4=CC=C(C=C4)OC(C)C

InChI

InChI=1S/C26H26N4O2/c1-17(2)32-21-13-11-19(12-14-21)16-27-26(31)25-29-23-10-5-4-9-22(23)24(30-25)28-20-8-6-7-18(3)15-20/h4-15,17H,16H2,1-3H3,(H,27,31)(H,28,29,30)