[2-[(5-aminocarbonyl-3-methoxycarbonyl-4-methyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]-[(1,3-dimethylpyrazol-4-yl)methyl]-methyl-azanium

Systemtic Name: [2-[(5-aminocarbonyl-3-methoxycarbonyl-4-methyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]-[(1,3-dimethylpyrazol-4-yl)methyl]-methyl-azanium Openeye Name: [2-[(5-carbamoyl-3-methoxycarbonyl-4-methyl-2-thienyl)amino]-2-oxo-ethyl]-[(1,3-dimethylpyrazol-4-yl)methyl]-methyl-ammonium CAS Name: [2-[(5-carbamoyl-3-methoxycarbonyl-4-methyl-2-thiophenyl)amino]-2-oxoethyl]-[(1,3-dimethyl-4-pyrazolyl)methyl]-methylammonium IUPAC Name: [2-[(5-carbamoyl-3-methoxycarbonyl-4-methylthiophen-2-yl)amino]-2-oxoethyl]-[(1,3-dimethylpyrazol-4-yl)methyl]-methylazanium Traditional Name: [2-[(5-carbamoyl-3-carbomethoxy-4-methyl-2-thienyl)amino]-2-keto-ethyl]-[(1,3-dimethylpyrazol-4-yl)methyl]-methyl-ammonium Formula: C17H24N5O4S+ MolecularWeight: 394.46856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)C[NH+](C)CC2=CN(N=C2C)C)C(=O)N

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)C[NH+](C)CC2=CN(N=C2C)C)C(=O)N

InChI

InChI=1S/C17H23N5O4S/c1-9-13(17(25)26-5)16(27-14(9)15(18)24)19-12(23)8-21(3)6-11-7-22(4)20-10(11)2/h7H,6,8H2,1-5H3,(H2,18,24)(H,19,23)/p+1