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

Systemtic Name: 4-[3-oxidanylidene-3-[6-[phenethyl(phenylsulfonyl)amino]-3,4-dihydro-2H-quinolin-1-yl]propyl]benzenecarboximidamide Openeye Name: 4-[3-[6-[benzenesulfonyl(phenethyl)amino]-3,4-dihydro-2H-quinolin-1-yl]-3-oxo-propyl]benzamidine CAS Name: 4-[3-[6-[benzenesulfonyl(phenethyl)amino]-3,4-dihydro-2H-quinolin-1-yl]-3-oxopropyl]benzenecarboximidamide IUPAC Name: 4-[3-[6-[benzenesulfonyl(phenethyl)amino]-3,4-dihydro-2H-quinolin-1-yl]-3-oxopropyl]benzenecarboximidamide Traditional Name: 4-[3-[6-[besyl(phenethyl)amino]-3,4-dihydro-2H-quinolin-1-yl]-3-keto-propyl]benzamidine Formula: C33H34N4O3S MolecularWeight: 566.71306

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)N(CCC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4)N(C1)C(=O)CCC5=CC=C(C=C5)C(=N)N

Isomeric SMILES

C1CC2=C(C=CC(=C2)N(CCC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4)N(C1)C(=O)CCC5=CC=C(C=C5)C(=N)N

InChI

InChI=1S/C33H34N4O3S/c34-33(35)27-16-13-26(14-17-27)15-20-32(38)36-22-7-10-28-24-29(18-19-31(28)36)37(23-21-25-8-3-1-4-9-25)41(39,40)30-11-5-2-6-12-30/h1-6,8-9,11-14,16-19,24H,7,10,15,20-23H2,(H3,34,35)