2-[2-[furan-2-ylmethyl-[[4-(methylcarbamoyl)phenyl]methyl]amino]ethanoylamino]thiophene-3-carboxamide

Systemtic Name: 2-[2-[furan-2-ylmethyl-[[4-(methylcarbamoyl)phenyl]methyl]amino]ethanoylamino]thiophene-3-carboxamide Openeye Name: 2-[[2-[2-furylmethyl-[[4-(methylcarbamoyl)phenyl]methyl]amino]acetyl]amino]thiophene-3-carboxamide CAS Name: 2-[[2-[2-furanylmethyl-[[4-(methylcarbamoyl)phenyl]methyl]amino]-1-oxoethyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[[2-[furan-2-ylmethyl-[[4-(methylcarbamoyl)phenyl]methyl]amino]acetyl]amino]thiophene-3-carboxamide Traditional Name: 2-[[2-[2-furfuryl-[4-(methylcarbamoyl)benzyl]amino]acetyl]amino]thiophene-3-carboxamide Formula: C21H22N4O4S MolecularWeight: 426.48878

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)CN(CC2=CC=CO2)CC(=O)NC3=C(C=CS3)C(=O)N

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)CN(CC2=CC=CO2)CC(=O)NC3=C(C=CS3)C(=O)N

InChI

InChI=1S/C21H22N4O4S/c1-23-20(28)15-6-4-14(5-7-15)11-25(12-16-3-2-9-29-16)13-18(26)24-21-17(19(22)27)8-10-30-21/h2-10H,11-13H2,1H3,(H2,22,27)(H,23,28)(H,24,26)