furan-2-ylmethyl-methyl-[2-[[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-prop-2-enyl-amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: furan-2-ylmethyl-methyl-[2-[[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-prop-2-enyl-amino]-2-oxidanylidene-ethyl]azanium Openeye Name: [2-[allyl-[4-(4-nitrophenyl)thiazol-2-yl]amino]-2-oxo-ethyl]-(2-furylmethyl)-methyl-ammonium CAS Name: 2-furanylmethyl-methyl-[2-[[4-(4-nitrophenyl)-2-thiazolyl]-prop-2-enylamino]-2-oxoethyl]ammonium IUPAC Name: furan-2-ylmethyl-methyl-[2-[[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-prop-2-enylamino]-2-oxoethyl]azanium Traditional Name: [2-[allyl-[4-(4-nitrophenyl)thiazol-2-yl]amino]-2-keto-ethyl]-(2-furfuryl)-methyl-ammonium Formula: C20H21N4O4S+ MolecularWeight: 413.47014

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CO1)CC(=O)N(CC=C)C2=NC(=CS2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C[NH+](CC1=CC=CO1)CC(=O)N(CC=C)C2=NC(=CS2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O4S/c1-3-10-23(19(25)13-22(2)12-17-5-4-11-28-17)20-21-18(14-29-20)15-6-8-16(9-7-15)24(26)27/h3-9,11,14H,1,10,12-13H2,2H3/p+1