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

Systemtic Name: N-[3-cyclohexyl-1-oxidanylidene-1-[[(4S)-3-oxidanylidene-1-pyridin-2-ylsulfonyl-azepan-4-yl]amino]propan-2-yl]furan-2-carboxamide Openeye Name: N-[1-(cyclohexylmethyl)-2-oxo-2-[[(4S)-3-oxo-1-(2-pyridylsulfonyl)azepan-4-yl]amino]ethyl]furan-2-carboxamide CAS Name: N-[3-cyclohexyl-1-oxo-1-[[(4S)-3-oxo-1-(2-pyridinylsulfonyl)-4-azepanyl]amino]propan-2-yl]-2-furancarboxamide IUPAC Name: N-[3-cyclohexyl-1-oxo-1-[[(4S)-3-oxo-1-pyridin-2-ylsulfonylazepan-4-yl]amino]propan-2-yl]furan-2-carboxamide Traditional Name: N-[1-(cyclohexylmethyl)-2-keto-2-[[(4S)-3-keto-1-(2-pyridylsulfonyl)azepan-4-yl]amino]ethyl]-2-furamide Formula: C25H32N4O6S MolecularWeight: 516.60978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(=O)NC2CCCN(CC2=O)S(=O)(=O)C3=CC=CC=N3)NC(=O)C4=CC=CO4

Isomeric SMILES

C1CCC(CC1)CC(C(=O)N[C@H]2CCCN(CC2=O)S(=O)(=O)C3=CC=CC=N3)NC(=O)C4=CC=CO4

InChI

InChI=1S/C25H32N4O6S/c30-21-17-29(36(33,34)23-12-4-5-13-26-23)14-6-10-19(21)27-24(31)20(16-18-8-2-1-3-9-18)28-25(32)22-11-7-15-35-22/h4-5,7,11-13,15,18-20H,1-3,6,8-10,14,16-17H2,(H,27,31)(H,28,32)/t19-,20?/m0/s1