N-[(2S)-1-[(4-ethoxy-3-piperidin-1-ylsulfonyl-phenyl)amino]-3-methyl-1-oxidanylidene-butan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[(2S)-1-[(4-ethoxy-3-piperidin-1-ylsulfonyl-phenyl)amino]-3-methyl-1-oxidanylidene-butan-2-yl]thiophene-2-carboxamide Openeye Name: N-[(1S)-1-[[4-ethoxy-3-(1-piperidylsulfonyl)phenyl]carbamoyl]-2-methyl-propyl]thiophene-2-carboxamide CAS Name: N-[(2S)-1-[4-ethoxy-3-(1-piperidinylsulfonyl)anilino]-3-methyl-1-oxobutan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[(2S)-1-(4-ethoxy-3-piperidin-1-ylsulfonylanilino)-3-methyl-1-oxobutan-2-yl]thiophene-2-carboxamide Traditional Name: N-[(1S)-1-[(4-ethoxy-3-piperidinosulfonyl-phenyl)carbamoyl]-2-methyl-propyl]thiophene-2-carboxamide Formula: C23H31N3O5S2 MolecularWeight: 493.63934

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C(C(C)C)NC(=O)C2=CC=CS2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)[C@H](C(C)C)NC(=O)C2=CC=CS2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C23H31N3O5S2/c1-4-31-18-11-10-17(15-20(18)33(29,30)26-12-6-5-7-13-26)24-23(28)21(16(2)3)25-22(27)19-9-8-14-32-19/h8-11,14-16,21H,4-7,12-13H2,1-3H3,(H,24,28)(H,25,27)/t21-/m0/s1