2-azanyl-7-(1-azanylethylideneamino)-5-sulfanylidene-heptanoic acid

Systemtic Name: 2-azanyl-7-(1-azanylethylideneamino)-5-sulfanylidene-heptanoic acid Openeye Name: 2-amino-7-(1-aminoethylideneamino)-5-thioxo-heptanoic acid CAS Name: 2-amino-7-(1-aminoethylideneamino)-5-sulfanylideneheptanoic acid IUPAC Name: 2-amino-7-(1-aminoethylideneamino)-5-sulfanylideneheptanoic acid Traditional Name: 2-amino-7-(1-aminoethylideneamino)-5-thioxo-enanthic acid Formula: C9H17N3O2S MolecularWeight: 231.31518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NCCC(=S)CCC(C(=O)O)N)N

Isomeric SMILES

CC(=NCCC(=S)CCC(C(=O)O)N)N

InChI

InChI=1S/C9H17N3O2S/c1-6(10)12-5-4-7(15)2-3-8(11)9(13)14/h8H,2-5,11H2,1H3,(H2,10,12)(H,13,14)