N-[5-[[4-methyl-1-[[1-(methylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-1-oxidanylidene-pentan-2-yl]amino]-4-[(2-nitrophenyl)disulfanyl]-5-oxidanylidene-pentyl]pyrazine-2-carboxamide

Systemtic Name: N-[5-[[4-methyl-1-[[1-(methylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-1-oxidanylidene-pentan-2-yl]amino]-4-[(2-nitrophenyl)disulfanyl]-5-oxidanylidene-pentyl]pyrazine-2-carboxamide Openeye Name: N-[5-[[1-[[1-benzyl-2-(methylamino)-2-oxo-ethyl]carbamoyl]-3-methyl-butyl]amino]-4-[(2-nitrophenyl)disulfanyl]-5-oxo-pentyl]pyrazine-2-carboxamide CAS Name: N-[5-[[4-methyl-1-[[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]amino]-1-oxopentan-2-yl]amino]-4-[(2-nitrophenyl)disulfanyl]-5-oxopentyl]-2-pyrazinecarboxamide IUPAC Name: N-[5-[[4-methyl-1-[[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]amino]-1-oxopentan-2-yl]amino]-4-[(2-nitrophenyl)disulfanyl]-5-oxopentyl]pyrazine-2-carboxamide Traditional Name: N-[5-[[1-[[1-benzyl-2-keto-2-(methylamino)ethyl]carbamoyl]-3-methyl-butyl]amino]-5-keto-4-[(2-nitrophenyl)disulfanyl]pentyl]pyrazinamide Formula: C32H39N7O6S2 MolecularWeight: 681.82536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)NC)NC(=O)C(CCCNC(=O)C2=NC=CN=C2)SSC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)NC)NC(=O)C(CCCNC(=O)C2=NC=CN=C2)SSC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C32H39N7O6S2/c1-21(2)18-23(31(42)37-24(29(40)33-3)19-22-10-5-4-6-11-22)38-32(43)28(47-46-27-13-8-7-12-26(27)39(44)45)14-9-15-36-30(41)25-20-34-16-17-35-25/h4-8,10-13,16-17,20-21,23-24,28H,9,14-15,18-19H2,1-3H3,(H,33,40)(H,36,41)(H,37,42)(H,38,43)