N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]prop-2-ene-1-sulfonamide

Systemtic Name: N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]prop-2-ene-1-sulfonamide Openeye Name: N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]prop-2-ene-1-sulfonamide CAS Name: N-[[4-(3-phenylpropylamino)-2-quinazolinyl]methyl]-2-propene-1-sulfonamide IUPAC Name: N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]prop-2-ene-1-sulfonamide Traditional Name: N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]prop-2-ene-1-sulfonamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

C=CCS(=O)(=O)NCC1=NC2=CC=CC=C2C(=N1)NCCCC3=CC=CC=C3

Isomeric SMILES

C=CCS(=O)(=O)NCC1=NC2=CC=CC=C2C(=N1)NCCCC3=CC=CC=C3

InChI

InChI=1S/C21H24N4O2S/c1-2-15-28(26,27)23-16-20-24-19-13-7-6-12-18(19)21(25-20)22-14-8-11-17-9-4-3-5-10-17/h2-7,9-10,12-13,23H,1,8,11,14-16H2,(H,22,24,25)