methyl-[(2R)-1-oxidanylidene-1-[(4-piperidin-1-ylsulfonylphenyl)amino]propan-2-yl]-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium

Systemtic Name: methyl-[(2R)-1-oxidanylidene-1-[(4-piperidin-1-ylsulfonylphenyl)amino]propan-2-yl]-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium Openeye Name: methyl-[(1R)-1-methyl-2-oxo-2-[4-(1-piperidylsulfonyl)anilino]ethyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium CAS Name: methyl-[(2R)-1-oxo-1-[4-(1-piperidinylsulfonyl)anilino]propan-2-yl]-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium IUPAC Name: methyl-[(2R)-1-oxo-1-(4-piperidin-1-ylsulfonylanilino)propan-2-yl]-[(4-oxo-1H-quinazolin-2-yl)methyl]azanium Traditional Name: [(1R)-2-keto-1-methyl-2-(4-piperidinosulfonylanilino)ethyl]-[(4-keto-1H-quinazolin-2-yl)methyl]-methyl-ammonium Formula: C24H30N5O4S+ MolecularWeight: 484.5911

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2)[NH+](C)CC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2)[NH+](C)CC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C24H29N5O4S/c1-17(28(2)16-22-26-21-9-5-4-8-20(21)24(31)27-22)23(30)25-18-10-12-19(13-11-18)34(32,33)29-14-6-3-7-15-29/h4-5,8-13,17H,3,6-7,14-16H2,1-2H3,(H,25,30)(H,26,27,31)/p+1/t17-/m1/s1