N-(phenylmethyl)-3-[(phenylmethyl)-(2-thiophen-2-ylquinazolin-4-yl)amino]propanamide

Systemtic Name: N-(phenylmethyl)-3-[(phenylmethyl)-(2-thiophen-2-ylquinazolin-4-yl)amino]propanamide Openeye Name: N-benzyl-3-[benzyl-[2-(2-thienyl)quinazolin-4-yl]amino]propanamide CAS Name: N-(phenylmethyl)-3-[(phenylmethyl)-(2-thiophen-2-yl-4-quinazolinyl)amino]propanamide IUPAC Name: N-benzyl-3-[benzyl-(2-thiophen-2-ylquinazolin-4-yl)amino]propanamide Traditional Name: N-benzyl-3-[benzyl-[2-(2-thienyl)quinazolin-4-yl]amino]propionamide Formula: C29H26N4OS MolecularWeight: 478.60794

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)CCN(CC2=CC=CC=C2)C3=NC(=NC4=CC=CC=C43)C5=CC=CS5

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)CCN(CC2=CC=CC=C2)C3=NC(=NC4=CC=CC=C43)C5=CC=CS5

InChI

InChI=1S/C29H26N4OS/c34-27(30-20-22-10-3-1-4-11-22)17-18-33(21-23-12-5-2-6-13-23)29-24-14-7-8-15-25(24)31-28(32-29)26-16-9-19-35-26/h1-16,19H,17-18,20-21H2,(H,30,34)