2-[2-[ethylsulfonyl-(phenylmethyl)amino]ethanoylamino]-4,5-dimethyl-thiophene-3-carboxamide

Systemtic Name: 2-[2-[ethylsulfonyl-(phenylmethyl)amino]ethanoylamino]-4,5-dimethyl-thiophene-3-carboxamide Openeye Name: 2-[[2-[benzyl(ethylsulfonyl)amino]acetyl]amino]-4,5-dimethyl-thiophene-3-carboxamide CAS Name: 2-[[2-[ethylsulfonyl-(phenylmethyl)amino]-1-oxoethyl]amino]-4,5-dimethyl-3-thiophenecarboxamide IUPAC Name: 2-[[2-[benzyl(ethylsulfonyl)amino]acetyl]amino]-4,5-dimethylthiophene-3-carboxamide Traditional Name: 2-[[2-[benzyl(esyl)amino]acetyl]amino]-4,5-dimethyl-thiophene-3-carboxamide Formula: C18H23N3O4S2 MolecularWeight: 409.52292

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N(CC1=CC=CC=C1)CC(=O)NC2=C(C(=C(S2)C)C)C(=O)N

Isomeric SMILES

CCS(=O)(=O)N(CC1=CC=CC=C1)CC(=O)NC2=C(C(=C(S2)C)C)C(=O)N

InChI

InChI=1S/C18H23N3O4S2/c1-4-27(24,25)21(10-14-8-6-5-7-9-14)11-15(22)20-18-16(17(19)23)12(2)13(3)26-18/h5-9H,4,10-11H2,1-3H3,(H2,19,23)(H,20,22)