[2-[[3-ethoxycarbonyl-4-(4-phenylphenyl)thiophen-2-yl]amino]-2-oxidanylidene-ethyl]-(furan-2-ylmethyl)azanium

Systemtic Name: [2-[[3-ethoxycarbonyl-4-(4-phenylphenyl)thiophen-2-yl]amino]-2-oxidanylidene-ethyl]-(furan-2-ylmethyl)azanium Openeye Name: [2-[[3-ethoxycarbonyl-4-(4-phenylphenyl)-2-thienyl]amino]-2-oxo-ethyl]-(2-furylmethyl)ammonium CAS Name: [2-[[3-ethoxycarbonyl-4-(4-phenylphenyl)-2-thiophenyl]amino]-2-oxoethyl]-(2-furanylmethyl)ammonium IUPAC Name: [2-[[3-ethoxycarbonyl-4-(4-phenylphenyl)thiophen-2-yl]amino]-2-oxoethyl]-(furan-2-ylmethyl)azanium Traditional Name: [2-[[3-carbethoxy-4-(4-phenylphenyl)-2-thienyl]amino]-2-keto-ethyl]-(2-furfuryl)ammonium Formula: C26H25N2O4S+ MolecularWeight: 461.5527

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C3=CC=CC=C3)NC(=O)C[NH2+]CC4=CC=CO4

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C3=CC=CC=C3)NC(=O)C[NH2+]CC4=CC=CO4

InChI

InChI=1S/C26H24N2O4S/c1-2-31-26(30)24-22(20-12-10-19(11-13-20)18-7-4-3-5-8-18)17-33-25(24)28-23(29)16-27-15-21-9-6-14-32-21/h3-14,17,27H,2,15-16H2,1H3,(H,28,29)/p+1