N-[3-cyclohexyl-1-oxidanylidene-1-[[(4S)-3-oxidanylidene-1-pyridin-2-ylsulfonyl-azepan-4-yl]amino]propan-2-yl]-5-pyridin-2-yl-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-pyridin-2-yl-thiophene-2-carboxamide Openeye Name: N-[1-(cyclohexylmethyl)-2-oxo-2-[[(4S)-3-oxo-1-(2-pyridylsulfonyl)azepan-4-yl]amino]ethyl]-5-(2-pyridyl)thiophene-2-carboxamide CAS Name: N-[3-cyclohexyl-1-oxo-1-[[(4S)-3-oxo-1-(2-pyridinylsulfonyl)-4-azepanyl]amino]propan-2-yl]-5-(2-pyridinyl)-2-thiophenecarboxamide IUPAC Name: N-[3-cyclohexyl-1-oxo-1-[[(4S)-3-oxo-1-pyridin-2-ylsulfonylazepan-4-yl]amino]propan-2-yl]-5-pyridin-2-ylthiophene-2-carboxamide Traditional Name: N-[1-(cyclohexylmethyl)-2-keto-2-[[(4S)-3-keto-1-(2-pyridylsulfonyl)azepan-4-yl]amino]ethyl]-5-(2-pyridyl)thiophene-2-carboxamide Formula: C30H35N5O5S2 MolecularWeight: 609.7594

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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)C4=CC=C(S4)C5=CC=CC=N5

Isomeric SMILES

C1CCC(CC1)CC(C(=O)N[C@H]2CCCN(CC2=O)S(=O)(=O)C3=CC=CC=N3)NC(=O)C4=CC=C(S4)C5=CC=CC=N5

InChI

InChI=1S/C30H35N5O5S2/c36-25-20-35(42(39,40)28-13-5-7-17-32-28)18-8-12-22(25)33-29(37)24(19-21-9-2-1-3-10-21)34-30(38)27-15-14-26(41-27)23-11-4-6-16-31-23/h4-7,11,13-17,21-22,24H,1-3,8-10,12,18-20H2,(H,33,37)(H,34,38)/t22-,24?/m0/s1