N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]thiophene-3-carboxamide

Systemtic Name: N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]thiophene-3-carboxamide Openeye Name: N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]thiophene-3-carboxamide CAS Name: N-[[4-(3-phenylpropylamino)-2-quinazolinyl]methyl]-3-thiophenecarboxamide IUPAC Name: N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]thiophene-3-carboxamide Traditional Name: N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]thiophene-3-carboxamide Formula: C23H22N4OS MolecularWeight: 402.51198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCNC2=NC(=NC3=CC=CC=C32)CNC(=O)C4=CSC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCCNC2=NC(=NC3=CC=CC=C32)CNC(=O)C4=CSC=C4

InChI

InChI=1S/C23H22N4OS/c28-23(18-12-14-29-16-18)25-15-21-26-20-11-5-4-10-19(20)22(27-21)24-13-6-9-17-7-2-1-3-8-17/h1-5,7-8,10-12,14,16H,6,9,13,15H2,(H,25,28)(H,24,26,27)