[2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl]-(furan-2-ylmethyl)-methyl-azanium

Systemtic Name: [2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl]-(furan-2-ylmethyl)-methyl-azanium Openeye Name: [2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-oxo-ethyl]-(2-furylmethyl)-methyl-ammonium CAS Name: [2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]-(2-furanylmethyl)-methylammonium IUPAC Name: [2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]-(furan-2-ylmethyl)-methylazanium Traditional Name: [2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-keto-ethyl]-(2-furfuryl)-methyl-ammonium Formula: C17H20N3O3S+ MolecularWeight: 346.424

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C[NH+](C)CC3=CC=CO3

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C[NH+](C)CC3=CC=CO3

InChI

InChI=1S/C17H19N3O3S/c1-3-22-12-6-7-14-15(9-12)24-17(18-14)19-16(21)11-20(2)10-13-5-4-8-23-13/h4-9H,3,10-11H2,1-2H3,(H,18,19,21)/p+1