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

Systemtic Name: butyl 4-[2-[4-(cyclopropylcarbonylamino)phenyl]sulfanylethanoylamino]benzoate Openeye Name: butyl 4-[[2-[4-(cyclopropanecarbonylamino)phenyl]sulfanylacetyl]amino]benzoate CAS Name: 4-[[2-[[4-[[cyclopropyl(oxo)methyl]amino]phenyl]thio]-1-oxoethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-[4-(cyclopropanecarbonylamino)phenyl]sulfanylacetyl]amino]benzoate Traditional Name: 4-[[2-[[4-(cyclopropanecarbonylamino)phenyl]thio]acetyl]amino]benzoic acid butyl ester Formula: C23H26N2O4S MolecularWeight: 426.52854

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=CC=C(C=C2)NC(=O)C3CC3

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=CC=C(C=C2)NC(=O)C3CC3

InChI

InChI=1S/C23H26N2O4S/c1-2-3-14-29-23(28)17-6-8-18(9-7-17)24-21(26)15-30-20-12-10-19(11-13-20)25-22(27)16-4-5-16/h6-13,16H,2-5,14-15H2,1H3,(H,24,26)(H,25,27)