N-(2-azanylethanoyl)-N-[(2S)-5-[bis(azanyl)methylideneamino]-2-methyl-1-oxidanylidene-5-phenyl-pentan-2-yl]azetidine-2-carboxamide

Systemtic Name: N-(2-azanylethanoyl)-N-[(2S)-5-[bis(azanyl)methylideneamino]-2-methyl-1-oxidanylidene-5-phenyl-pentan-2-yl]azetidine-2-carboxamide Openeye Name: N-(2-aminoacetyl)-N-[(1S)-1-formyl-4-guanidino-1-methyl-4-phenyl-butyl]azetidine-2-carboxamide CAS Name: N-(2-amino-1-oxoethyl)-N-[(2S)-5-(diaminomethylideneamino)-2-methyl-1-oxo-5-phenylpentan-2-yl]-2-azetidinecarboxamide IUPAC Name: N-(2-aminoacetyl)-N-[(2S)-5-(diaminomethylideneamino)-2-methyl-1-oxo-5-phenylpentan-2-yl]azetidine-2-carboxamide Traditional Name: N-[(1S)-1-formyl-4-guanidino-1-methyl-4-phenyl-butyl]-N-glycyl-azetidine-2-carboxamide Formula: C19H28N6O3 MolecularWeight: 388.46402

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(C1=CC=CC=C1)N=C(N)N)(C=O)N(C(=O)CN)C(=O)C2CCN2

Isomeric SMILES

C[C@](CCC(C1=CC=CC=C1)N=C(N)N)(C=O)N(C(=O)CN)C(=O)C2CCN2

InChI

InChI=1S/C19H28N6O3/c1-19(12-26,25(16(27)11-20)17(28)15-8-10-23-15)9-7-14(24-18(21)22)13-5-3-2-4-6-13/h2-6,12,14-15,23H,7-11,20H2,1H3,(H4,21,22,24)/t14?,15?,19-/m0/s1