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

Systemtic Name: [2-[(5-aminocarbonyl-4-methyl-3-propan-2-yloxycarbonyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]-[(1,5-dimethylpyrazol-4-yl)methyl]-methyl-azanium Openeye Name: [2-[(5-carbamoyl-3-isopropoxycarbonyl-4-methyl-2-thienyl)amino]-2-oxo-ethyl]-[(1,5-dimethylpyrazol-4-yl)methyl]-methyl-ammonium CAS Name: [2-[[5-carbamoyl-4-methyl-3-[oxo(propan-2-yloxy)methyl]-2-thiophenyl]amino]-2-oxoethyl]-[(1,5-dimethyl-4-pyrazolyl)methyl]-methylammonium IUPAC Name: [2-[(5-carbamoyl-4-methyl-3-propan-2-yloxycarbonylthiophen-2-yl)amino]-2-oxoethyl]-[(1,5-dimethylpyrazol-4-yl)methyl]-methylazanium Traditional Name: [2-[(5-carbamoyl-3-isopropoxycarbonyl-4-methyl-2-thienyl)amino]-2-keto-ethyl]-[(1,5-dimethylpyrazol-4-yl)methyl]-methyl-ammonium Formula: C19H28N5O4S+ MolecularWeight: 422.52172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC(C)C)NC(=O)C[NH+](C)CC2=C(N(N=C2)C)C)C(=O)N

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC(C)C)NC(=O)C[NH+](C)CC2=C(N(N=C2)C)C)C(=O)N

InChI

InChI=1S/C19H27N5O4S/c1-10(2)28-19(27)15-11(3)16(17(20)26)29-18(15)22-14(25)9-23(5)8-13-7-21-24(6)12(13)4/h7,10H,8-9H2,1-6H3,(H2,20,26)(H,22,25)/p+1