acetamido 2-azanyl-2-[[2-[bis(azanyl)methylideneamino]-1,3-thiazol-4-yl]carbonyl]-4-oxidanylidene-4-piperidin-1-yl-butanoate

Systemtic Name: acetamido 2-azanyl-2-[[2-[bis(azanyl)methylideneamino]-1,3-thiazol-4-yl]carbonyl]-4-oxidanylidene-4-piperidin-1-yl-butanoate Openeye Name: acetamido 2-amino-2-(2-guanidinothiazole-4-carbonyl)-4-oxo-4-(1-piperidyl)butanoate CAS Name: 2-amino-2-[[2-(diaminomethylideneamino)-4-thiazolyl]-oxomethyl]-4-oxo-4-(1-piperidinyl)butanoic acid acetamido ester IUPAC Name: acetamido 2-amino-2-[2-(diaminomethylideneamino)-1,3-thiazole-4-carbonyl]-4-oxo-4-piperidin-1-ylbutanoate Traditional Name: 2-amino-2-(2-guanidinothiazole-4-carbonyl)-4-keto-4-piperidino-butyric acid acetamido ester Formula: C16H23N7O5S MolecularWeight: 425.46272

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NOC(=O)C(CC(=O)N1CCCCC1)(C(=O)C2=CSC(=N2)N=C(N)N)N

Isomeric SMILES

CC(=O)NOC(=O)C(CC(=O)N1CCCCC1)(C(=O)C2=CSC(=N2)N=C(N)N)N

InChI

InChI=1S/C16H23N7O5S/c1-9(24)22-28-13(27)16(19,7-11(25)23-5-3-2-4-6-23)12(26)10-8-29-15(20-10)21-14(17)18/h8H,2-7,19H2,1H3,(H,22,24)(H4,17,18,20,21)