N-[3-cyclohexyl-1-oxidanylidene-1-[[(4S)-3-oxidanylidene-1-pyridin-2-ylsulfonyl-azepan-4-yl]amino]propan-2-yl]cyclobutanecarboxamide

Systemtic Name: N-[3-cyclohexyl-1-oxidanylidene-1-[[(4S)-3-oxidanylidene-1-pyridin-2-ylsulfonyl-azepan-4-yl]amino]propan-2-yl]cyclobutanecarboxamide Openeye Name: N-[1-(cyclohexylmethyl)-2-oxo-2-[[(4S)-3-oxo-1-(2-pyridylsulfonyl)azepan-4-yl]amino]ethyl]cyclobutanecarboxamide CAS Name: N-[3-cyclohexyl-1-oxo-1-[[(4S)-3-oxo-1-(2-pyridinylsulfonyl)-4-azepanyl]amino]propan-2-yl]cyclobutanecarboxamide IUPAC Name: N-[3-cyclohexyl-1-oxo-1-[[(4S)-3-oxo-1-pyridin-2-ylsulfonylazepan-4-yl]amino]propan-2-yl]cyclobutanecarboxamide Traditional Name: N-[1-(cyclohexylmethyl)-2-keto-2-[[(4S)-3-keto-1-(2-pyridylsulfonyl)azepan-4-yl]amino]ethyl]cyclobutanecarboxamide Formula: C25H36N4O5S MolecularWeight: 504.64214

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(=O)NC2CCCN(CC2=O)S(=O)(=O)C3=CC=CC=N3)NC(=O)C4CCC4

Isomeric SMILES

C1CCC(CC1)CC(C(=O)N[C@H]2CCCN(CC2=O)S(=O)(=O)C3=CC=CC=N3)NC(=O)C4CCC4

InChI

InChI=1S/C25H36N4O5S/c30-22-17-29(35(33,34)23-13-4-5-14-26-23)15-7-12-20(22)27-25(32)21(16-18-8-2-1-3-9-18)28-24(31)19-10-6-11-19/h4-5,13-14,18-21H,1-3,6-12,15-17H2,(H,27,32)(H,28,31)/t20-,21?/m0/s1