N-[4-[2-(3-pyrrolidin-1-ylpropylamino)-5,6-dihydrobenzo[h]quinazolin-6-yl]phenyl]benzenesulfonamide

Systemtic Name: N-[4-[2-(3-pyrrolidin-1-ylpropylamino)-5,6-dihydrobenzo[h]quinazolin-6-yl]phenyl]benzenesulfonamide Openeye Name: N-[4-[2-(3-pyrrolidin-1-ylpropylamino)-5,6-dihydrobenzo[h]quinazolin-6-yl]phenyl]benzenesulfonamide CAS Name: N-[4-[2-[3-(1-pyrrolidinyl)propylamino]-5,6-dihydrobenzo[h]quinazolin-6-yl]phenyl]benzenesulfonamide IUPAC Name: N-[4-[2-(3-pyrrolidin-1-ylpropylamino)-5,6-dihydrobenzo[h]quinazolin-6-yl]phenyl]benzenesulfonamide Traditional Name: N-[4-[2-(3-pyrrolidinopropylamino)-5,6-dihydrobenzo[h]quinazolin-6-yl]phenyl]benzenesulfonamide Formula: C31H33N5O2S MolecularWeight: 539.69102

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCCNC2=NC=C3CC(C4=CC=CC=C4C3=N2)C5=CC=C(C=C5)NS(=O)(=O)C6=CC=CC=C6

Isomeric SMILES

C1CCN(C1)CCCNC2=NC=C3CC(C4=CC=CC=C4C3=N2)C5=CC=C(C=C5)NS(=O)(=O)C6=CC=CC=C6

InChI

InChI=1S/C31H33N5O2S/c37-39(38,26-9-2-1-3-10-26)35-25-15-13-23(14-16-25)29-21-24-22-33-31(32-17-8-20-36-18-6-7-19-36)34-30(24)28-12-5-4-11-27(28)29/h1-5,9-16,22,29,35H,6-8,17-21H2,(H,32,33,34)