N-[3-cyclohexyl-1-oxidanylidene-1-[[(4S)-3-oxidanylidene-1-pyridin-2-ylsulfonyl-azepan-4-yl]amino]propan-2-yl]-5-methyl-thiophene-2-carboxamide

Systemtic Name: N-[3-cyclohexyl-1-oxidanylidene-1-[[(4S)-3-oxidanylidene-1-pyridin-2-ylsulfonyl-azepan-4-yl]amino]propan-2-yl]-5-methyl-thiophene-2-carboxamide Openeye Name: N-[1-(cyclohexylmethyl)-2-oxo-2-[[(4S)-3-oxo-1-(2-pyridylsulfonyl)azepan-4-yl]amino]ethyl]-5-methyl-thiophene-2-carboxamide CAS Name: N-[3-cyclohexyl-1-oxo-1-[[(4S)-3-oxo-1-(2-pyridinylsulfonyl)-4-azepanyl]amino]propan-2-yl]-5-methyl-2-thiophenecarboxamide IUPAC Name: N-[3-cyclohexyl-1-oxo-1-[[(4S)-3-oxo-1-pyridin-2-ylsulfonylazepan-4-yl]amino]propan-2-yl]-5-methylthiophene-2-carboxamide Traditional Name: N-[1-(cyclohexylmethyl)-2-keto-2-[[(4S)-3-keto-1-(2-pyridylsulfonyl)azepan-4-yl]amino]ethyl]-5-methyl-thiophene-2-carboxamide Formula: C26H34N4O5S2 MolecularWeight: 546.70196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)NC(CC2CCCCC2)C(=O)NC3CCCN(CC3=O)S(=O)(=O)C4=CC=CC=N4

Isomeric SMILES

CC1=CC=C(S1)C(=O)NC(CC2CCCCC2)C(=O)N[C@H]3CCCN(CC3=O)S(=O)(=O)C4=CC=CC=N4

InChI

InChI=1S/C26H34N4O5S2/c1-18-12-13-23(36-18)26(33)29-21(16-19-8-3-2-4-9-19)25(32)28-20-10-7-15-30(17-22(20)31)37(34,35)24-11-5-6-14-27-24/h5-6,11-14,19-21H,2-4,7-10,15-17H2,1H3,(H,28,32)(H,29,33)/t20-,21?/m0/s1