cyclopropyl-[2-[[3-ethoxycarbonyl-4-methyl-5-(phenylcarbamoyl)thiophen-2-yl]amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: cyclopropyl-[2-[[3-ethoxycarbonyl-4-methyl-5-(phenylcarbamoyl)thiophen-2-yl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: cyclopropyl-[2-[[3-ethoxycarbonyl-4-methyl-5-(phenylcarbamoyl)-2-thienyl]amino]-2-oxo-ethyl]ammonium CAS Name: [2-[[5-[anilino(oxo)methyl]-3-ethoxycarbonyl-4-methyl-2-thiophenyl]amino]-2-oxoethyl]-cyclopropylammonium IUPAC Name: cyclopropyl-[2-[[3-ethoxycarbonyl-4-methyl-5-(phenylcarbamoyl)thiophen-2-yl]amino]-2-oxoethyl]azanium Traditional Name: [2-[[3-carbethoxy-4-methyl-5-(phenylcarbamoyl)-2-thienyl]amino]-2-keto-ethyl]-cyclopropyl-ammonium Formula: C20H24N3O4S+ MolecularWeight: 402.48726

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=CC=C2)NC(=O)C[NH2+]C3CC3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=CC=C2)NC(=O)C[NH2+]C3CC3

InChI

InChI=1S/C20H23N3O4S/c1-3-27-20(26)16-12(2)17(18(25)22-14-7-5-4-6-8-14)28-19(16)23-15(24)11-21-13-9-10-13/h4-8,13,21H,3,9-11H2,1-2H3,(H,22,25)(H,23,24)/p+1