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

Systemtic Name: N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]thiophene-3-sulfonamide Openeye Name: N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]thiophene-3-sulfonamide CAS Name: N-[[4-(3-phenylpropylamino)-2-quinazolinyl]methyl]-3-thiophenesulfonamide IUPAC Name: N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]thiophene-3-sulfonamide Traditional Name: N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]thiophene-3-sulfonamide Formula: C22H22N4O2S2 MolecularWeight: 438.56568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22N4O2S2/c27-30(28,18-12-14-29-16-18)24-15-21-25-20-11-5-4-10-19(20)22(26-21)23-13-6-9-17-7-2-1-3-8-17/h1-5,7-8,10-12,14,16,24H,6,9,13,15H2,(H,23,25,26)