2-acetamido-2-azanyl-4-[2-[bis(azanyl)methylideneamino]-4-propyl-1,3-thiazol-5-yl]-4-oxidanylidene-3-phenyl-butanoic acid

Systemtic Name: 2-acetamido-2-azanyl-4-[2-[bis(azanyl)methylideneamino]-4-propyl-1,3-thiazol-5-yl]-4-oxidanylidene-3-phenyl-butanoic acid Openeye Name: 2-acetamido-2-amino-4-(2-guanidino-4-propyl-thiazol-5-yl)-4-oxo-3-phenyl-butanoic acid CAS Name: 2-acetamido-2-amino-4-[2-(diaminomethylideneamino)-4-propyl-5-thiazolyl]-4-oxo-3-phenylbutanoic acid IUPAC Name: 2-acetamido-2-amino-4-[2-(diaminomethylideneamino)-4-propyl-1,3-thiazol-5-yl]-4-oxo-3-phenylbutanoic acid Traditional Name: 2-acetamido-2-amino-4-(2-guanidino-4-propyl-thiazol-5-yl)-4-keto-3-phenyl-butyric acid Formula: C19H24N6O4S MolecularWeight: 432.49666

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(SC(=N1)N=C(N)N)C(=O)C(C2=CC=CC=C2)C(C(=O)O)(N)NC(=O)C

Isomeric SMILES

CCCC1=C(SC(=N1)N=C(N)N)C(=O)C(C2=CC=CC=C2)C(C(=O)O)(N)NC(=O)C

InChI

InChI=1S/C19H24N6O4S/c1-3-7-12-15(30-18(23-12)24-17(20)21)14(27)13(11-8-5-4-6-9-11)19(22,16(28)29)25-10(2)26/h4-6,8-9,13H,3,7,22H2,1-2H3,(H,25,26)(H,28,29)(H4,20,21,23,24)