N-[6-[aminocarbonyl(phenyl)amino]-5-oxidanylidene-hexyl]-3-azanyl-5-ethylsulfanyl-2-oxidanyl-pentanamide

Systemtic Name: N-[6-[aminocarbonyl(phenyl)amino]-5-oxidanylidene-hexyl]-3-azanyl-5-ethylsulfanyl-2-oxidanyl-pentanamide Openeye Name: 3-amino-N-[6-(N-carbamoylanilino)-5-oxo-hexyl]-5-ethylsulfanyl-2-hydroxy-pentanamide CAS Name: 3-amino-N-[6-(N-carbamoylanilino)-5-oxohexyl]-5-(ethylthio)-2-hydroxypentanamide IUPAC Name: 3-amino-N-[6-(N-carbamoylanilino)-5-oxohexyl]-5-ethylsulfanyl-2-hydroxypentanamide Traditional Name: 3-amino-N-[6-(N-carbamoylanilino)-5-keto-hexyl]-5-(ethylthio)-2-hydroxy-valeramide Formula: C20H32N4O4S MolecularWeight: 424.55748

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Descriptors Computed from Structure

Canonical SMILES:

CCSCCC(C(C(=O)NCCCCC(=O)CN(C1=CC=CC=C1)C(=O)N)O)N

Isomeric SMILES

CCSCCC(C(C(=O)NCCCCC(=O)CN(C1=CC=CC=C1)C(=O)N)O)N

InChI

InChI=1S/C20H32N4O4S/c1-2-29-13-11-17(21)18(26)19(27)23-12-7-6-10-16(25)14-24(20(22)28)15-8-4-3-5-9-15/h3-5,8-9,17-18,26H,2,6-7,10-14,21H2,1H3,(H2,22,28)(H,23,27)