5-[[(3-azanyl-3-oxidanylidene-propanoyl)amino]-phenyl-amino]-5-sulfanylidene-pentanoic acid

Systemtic Name: 5-[[(3-azanyl-3-oxidanylidene-propanoyl)amino]-phenyl-amino]-5-sulfanylidene-pentanoic acid Openeye Name: 5-(N-[(3-amino-3-oxo-propanoyl)amino]anilino)-5-thioxo-pentanoic acid CAS Name: 5-(N-[(3-amino-1,3-dioxopropyl)amino]anilino)-5-sulfanylidenepentanoic acid IUPAC Name: 5-(N-[(3-amino-3-oxopropanoyl)amino]anilino)-5-sulfanylidenepentanoic acid Traditional Name: 5-(N-[(3-amino-3-keto-propanoyl)amino]anilino)-5-thioxo-valeric acid Formula: C14H17N3O4S MolecularWeight: 323.36748

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(C(=S)CCCC(=O)O)NC(=O)CC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)N(C(=S)CCCC(=O)O)NC(=O)CC(=O)N

InChI

InChI=1S/C14H17N3O4S/c15-11(18)9-12(19)16-17(10-5-2-1-3-6-10)13(22)7-4-8-14(20)21/h1-3,5-6H,4,7-9H2,(H2,15,18)(H,16,19)(H,20,21)