4-[3-oxidanylidene-3-[6-(phenylsulfonyl)-3,4-dihydro-2H-quinolin-1-yl]propyl]benzenecarboximidamide

Systemtic Name: 4-[3-oxidanylidene-3-[6-(phenylsulfonyl)-3,4-dihydro-2H-quinolin-1-yl]propyl]benzenecarboximidamide Openeye Name: 4-[3-[6-(benzenesulfonyl)-3,4-dihydro-2H-quinolin-1-yl]-3-oxo-propyl]benzamidine CAS Name: 4-[3-[6-(benzenesulfonyl)-3,4-dihydro-2H-quinolin-1-yl]-3-oxopropyl]benzenecarboximidamide IUPAC Name: 4-[3-[6-(benzenesulfonyl)-3,4-dihydro-2H-quinolin-1-yl]-3-oxopropyl]benzenecarboximidamide Traditional Name: 4-[3-(6-besyl-3,4-dihydro-2H-quinolin-1-yl)-3-keto-propyl]benzamidine Formula: C25H25N3O3S MolecularWeight: 447.5493

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)S(=O)(=O)C3=CC=CC=C3)N(C1)C(=O)CCC4=CC=C(C=C4)C(=N)N

Isomeric SMILES

C1CC2=C(C=CC(=C2)S(=O)(=O)C3=CC=CC=C3)N(C1)C(=O)CCC4=CC=C(C=C4)C(=N)N

InChI

InChI=1S/C25H25N3O3S/c26-25(27)19-11-8-18(9-12-19)10-15-24(29)28-16-4-5-20-17-22(13-14-23(20)28)32(30,31)21-6-2-1-3-7-21/h1-3,6-9,11-14,17H,4-5,10,15-16H2,(H3,26,27)