N-[3-butylsulfonyl-1-[[6-methyl-5-(2-methylpropylcarbamoyl)-3,4-bis(oxidanyl)-1-phenyl-heptan-2-yl]amino]-1-oxidanylidene-propan-2-yl]pyridine-3-carboxamide

Systemtic Name: N-[3-butylsulfonyl-1-[[6-methyl-5-(2-methylpropylcarbamoyl)-3,4-bis(oxidanyl)-1-phenyl-heptan-2-yl]amino]-1-oxidanylidene-propan-2-yl]pyridine-3-carboxamide Openeye Name: N-[2-[[1-benzyl-2,3-dihydroxy-4-(isobutylcarbamoyl)-5-methyl-hexyl]amino]-1-(butylsulfonylmethyl)-2-oxo-ethyl]pyridine-3-carboxamide CAS Name: N-[3-butylsulfonyl-1-[[3,4-dihydroxy-6-methyl-5-[(2-methylpropylamino)-oxomethyl]-1-phenylheptan-2-yl]amino]-1-oxopropan-2-yl]-3-pyridinecarboxamide IUPAC Name: N-[3-butylsulfonyl-1-[[3,4-dihydroxy-6-methyl-5-(2-methylpropylcarbamoyl)-1-phenylheptan-2-yl]amino]-1-oxopropan-2-yl]pyridine-3-carboxamide Traditional Name: N-[2-[[1-benzyl-2,3-dihydroxy-4-(isobutylcarbamoyl)-5-methyl-hexyl]amino]-1-(butylsulfonylmethyl)-2-keto-ethyl]nicotinamide Formula: C32H48N4O7S MolecularWeight: 632.81112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)CC(C(=O)NC(CC1=CC=CC=C1)C(C(C(C(C)C)C(=O)NCC(C)C)O)O)NC(=O)C2=CN=CC=C2

Isomeric SMILES

CCCCS(=O)(=O)CC(C(=O)NC(CC1=CC=CC=C1)C(C(C(C(C)C)C(=O)NCC(C)C)O)O)NC(=O)C2=CN=CC=C2

InChI

InChI=1S/C32H48N4O7S/c1-6-7-16-44(42,43)20-26(36-30(39)24-14-11-15-33-19-24)31(40)35-25(17-23-12-9-8-10-13-23)28(37)29(38)27(22(4)5)32(41)34-18-21(2)3/h8-15,19,21-22,25-29,37-38H,6-7,16-18,20H2,1-5H3,(H,34,41)(H,35,40)(H,36,39)