methyl 4-[[6-[[5-(2-methoxyethyl)-4-methyl-thiophen-2-yl]sulfonylcarbamoylamino]-4-methylsulfanyl-pyridin-2-yl]amino]butanoate

Systemtic Name: methyl 4-[[6-[[5-(2-methoxyethyl)-4-methyl-thiophen-2-yl]sulfonylcarbamoylamino]-4-methylsulfanyl-pyridin-2-yl]amino]butanoate Openeye Name: methyl 4-[[6-[[5-(2-methoxyethyl)-4-methyl-2-thienyl]sulfonylcarbamoylamino]-4-methylsulfanyl-2-pyridyl]amino]butanoate CAS Name: 4-[[6-[[[[5-(2-methoxyethyl)-4-methyl-2-thiophenyl]sulfonylamino]-oxomethyl]amino]-4-(methylthio)-2-pyridinyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[6-[[5-(2-methoxyethyl)-4-methylthiophen-2-yl]sulfonylcarbamoylamino]-4-methylsulfanylpyridin-2-yl]amino]butanoate Traditional Name: 4-[[6-[[5-(2-methoxyethyl)-4-methyl-2-thienyl]sulfonylcarbamoylamino]-4-(methylthio)-2-pyridyl]amino]butyric acid methyl ester Formula: C20H28N4O6S3 MolecularWeight: 516.65452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)S(=O)(=O)NC(=O)NC2=NC(=CC(=C2)SC)NCCCC(=O)OC)CCOC

Isomeric SMILES

CC1=C(SC(=C1)S(=O)(=O)NC(=O)NC2=NC(=CC(=C2)SC)NCCCC(=O)OC)CCOC

InChI

InChI=1S/C20H28N4O6S3/c1-13-10-19(32-15(13)7-9-29-2)33(27,28)24-20(26)23-17-12-14(31-4)11-16(22-17)21-8-5-6-18(25)30-3/h10-12H,5-9H2,1-4H3,(H3,21,22,23,24,26)