2-azanyl-N-[6,10-bis(azanyl)-4-chloranyl-3,5-bis(oxidanylidene)-1-phenyl-decan-2-yl]-3-methyl-butanamide

Systemtic Name: 2-azanyl-N-[6,10-bis(azanyl)-4-chloranyl-3,5-bis(oxidanylidene)-1-phenyl-decan-2-yl]-3-methyl-butanamide Openeye Name: 2-amino-N-(5,9-diamino-1-benzyl-3-chloro-2,4-dioxo-nonyl)-3-methyl-butanamide CAS Name: 2-amino-N-(6,10-diamino-4-chloro-3,5-dioxo-1-phenyldecan-2-yl)-3-methylbutanamide IUPAC Name: 2-amino-N-(6,10-diamino-4-chloro-3,5-dioxo-1-phenyldecan-2-yl)-3-methylbutanamide Traditional Name: 2-amino-N-(5,9-diamino-1-benzyl-3-chloro-2,4-diketo-nonyl)-3-methyl-butyramide Formula: C21H33ClN4O3 MolecularWeight: 424.96472

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(CC1=CC=CC=C1)C(=O)C(C(=O)C(CCCCN)N)Cl)N

Isomeric SMILES

CC(C)C(C(=O)NC(CC1=CC=CC=C1)C(=O)C(C(=O)C(CCCCN)N)Cl)N

InChI

InChI=1S/C21H33ClN4O3/c1-13(2)18(25)21(29)26-16(12-14-8-4-3-5-9-14)20(28)17(22)19(27)15(24)10-6-7-11-23/h3-5,8-9,13,15-18H,6-7,10-12,23-25H2,1-2H3,(H,26,29)