furan-2-ylmethyl-[2-[(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: furan-2-ylmethyl-[2-[(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: 2-furylmethyl-[2-(5-morpholinosulfonyl-2-pyrrolidin-1-yl-anilino)-2-oxo-ethyl]ammonium CAS Name: 2-furanylmethyl-[2-[5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)anilino]-2-oxoethyl]ammonium IUPAC Name: furan-2-ylmethyl-[2-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylanilino)-2-oxoethyl]azanium Traditional Name: 2-furfuryl-[2-keto-2-(5-morpholinosulfonyl-2-pyrrolidino-anilino)ethyl]ammonium Formula: C21H29N4O5S+ MolecularWeight: 449.54376

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)C[NH2+]CC4=CC=CO4

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)C[NH2+]CC4=CC=CO4

InChI

InChI=1S/C21H28N4O5S/c26-21(16-22-15-17-4-3-11-30-17)23-19-14-18(5-6-20(19)24-7-1-2-8-24)31(27,28)25-9-12-29-13-10-25/h3-6,11,14,22H,1-2,7-10,12-13,15-16H2,(H,23,26)/p+1