methyl 2-[2-[4-(cyclopropylcarbonylamino)phenyl]sulfanylethanoylamino]benzoate

Systemtic Name: methyl 2-[2-[4-(cyclopropylcarbonylamino)phenyl]sulfanylethanoylamino]benzoate Openeye Name: methyl 2-[[2-[4-(cyclopropanecarbonylamino)phenyl]sulfanylacetyl]amino]benzoate CAS Name: 2-[[2-[[4-[[cyclopropyl(oxo)methyl]amino]phenyl]thio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-[4-(cyclopropanecarbonylamino)phenyl]sulfanylacetyl]amino]benzoate Traditional Name: 2-[[2-[[4-(cyclopropanecarbonylamino)phenyl]thio]acetyl]amino]benzoic acid methyl ester Formula: C20H20N2O4S MolecularWeight: 384.4488

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)CSC2=CC=C(C=C2)NC(=O)C3CC3

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)CSC2=CC=C(C=C2)NC(=O)C3CC3

InChI

InChI=1S/C20H20N2O4S/c1-26-20(25)16-4-2-3-5-17(16)22-18(23)12-27-15-10-8-14(9-11-15)21-19(24)13-6-7-13/h2-5,8-11,13H,6-7,12H2,1H3,(H,21,24)(H,22,23)