[5-azanyl-4-ethoxycarbonyl-2-(methylcarbamoyl)thiophen-3-yl]methyl-(1,3-benzothiazol-2-ylmethyl)-methyl-azanium

Systemtic Name: [5-azanyl-4-ethoxycarbonyl-2-(methylcarbamoyl)thiophen-3-yl]methyl-(1,3-benzothiazol-2-ylmethyl)-methyl-azanium Openeye Name: [5-amino-4-ethoxycarbonyl-2-(methylcarbamoyl)-3-thienyl]methyl-(1,3-benzothiazol-2-ylmethyl)-methyl-ammonium CAS Name: [5-amino-4-ethoxycarbonyl-2-(methylcarbamoyl)-3-thiophenyl]methyl-(1,3-benzothiazol-2-ylmethyl)-methylammonium IUPAC Name: [5-amino-4-ethoxycarbonyl-2-(methylcarbamoyl)thiophen-3-yl]methyl-(1,3-benzothiazol-2-ylmethyl)-methylazanium Traditional Name: [5-amino-4-carbethoxy-2-(methylcarbamoyl)-3-thienyl]methyl-(1,3-benzothiazol-2-ylmethyl)-methyl-ammonium Formula: C19H23N4O3S2+ MolecularWeight: 419.54092

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C[NH+](C)CC2=NC3=CC=CC=C3S2)C(=O)NC)N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C[NH+](C)CC2=NC3=CC=CC=C3S2)C(=O)NC)N

InChI

InChI=1S/C19H22N4O3S2/c1-4-26-19(25)15-11(16(18(24)21-2)28-17(15)20)9-23(3)10-14-22-12-7-5-6-8-13(12)27-14/h5-8H,4,9-10,20H2,1-3H3,(H,21,24)/p+1