N-(4-azanylquinazolin-6-yl)-2-[1-[3-phenyl-2-[(phenylmethyl)sulfonylamino]propanoyl]pyrrolidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(4-azanylquinazolin-6-yl)-2-[1-[3-phenyl-2-[(phenylmethyl)sulfonylamino]propanoyl]pyrrolidin-1-ium-1-yl]ethanamide Openeye Name: N-(4-aminoquinazolin-6-yl)-2-[1-[2-(benzylsulfonylamino)-3-phenyl-propanoyl]pyrrolidin-1-ium-1-yl]acetamide CAS Name: N-(4-amino-6-quinazolinyl)-2-[1-[1-oxo-3-phenyl-2-[(phenylmethyl)sulfonylamino]propyl]-1-pyrrolidin-1-iumyl]acetamide IUPAC Name: N-(4-aminoquinazolin-6-yl)-2-[1-[2-(benzylsulfonylamino)-3-phenylpropanoyl]pyrrolidin-1-ium-1-yl]acetamide Traditional Name: N-(4-aminoquinazolin-6-yl)-2-[1-[2-(benzylsulfonylamino)-3-phenyl-propanoyl]pyrrolidin-1-ium-1-yl]acetamide Formula: C30H33N6O4S+ MolecularWeight: 573.68582

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](C1)(CC(=O)NC2=CC3=C(C=C2)N=CN=C3N)C(=O)C(CC4=CC=CC=C4)NS(=O)(=O)CC5=CC=CC=C5

Isomeric SMILES

C1CC[N+](C1)(CC(=O)NC2=CC3=C(C=C2)N=CN=C3N)C(=O)C(CC4=CC=CC=C4)NS(=O)(=O)CC5=CC=CC=C5

InChI

InChI=1S/C30H32N6O4S/c31-29-25-18-24(13-14-26(25)32-21-33-29)34-28(37)19-36(15-7-8-16-36)30(38)27(17-22-9-3-1-4-10-22)35-41(39,40)20-23-11-5-2-6-12-23/h1-6,9-14,18,21,27,35H,7-8,15-17,19-20H2,(H2-,31,32,33,34,37)/p+1