N-[1-[4-(aminomethyl)-2-oxidanylidene-chromen-3-yl]-6-azanyl-1-oxidanylidene-hexan-2-yl]-2-[(2-azanyl-3-methyl-butanoyl)amino]-4-methyl-pentanamide

Systemtic Name: N-[1-[4-(aminomethyl)-2-oxidanylidene-chromen-3-yl]-6-azanyl-1-oxidanylidene-hexan-2-yl]-2-[(2-azanyl-3-methyl-butanoyl)amino]-4-methyl-pentanamide Openeye Name: N-[5-amino-1-[4-(aminomethyl)-2-oxo-chromene-3-carbonyl]pentyl]-2-[(2-amino-3-methyl-butanoyl)amino]-4-methyl-pentanamide CAS Name: N-[6-amino-1-[4-(aminomethyl)-2-oxo-1-benzopyran-3-yl]-1-oxohexan-2-yl]-2-[(2-amino-3-methyl-1-oxobutyl)amino]-4-methylpentanamide IUPAC Name: N-[6-amino-1-[4-(aminomethyl)-2-oxochromen-3-yl]-1-oxohexan-2-yl]-2-[(2-amino-3-methylbutanoyl)amino]-4-methylpentanamide Traditional Name: N-[5-amino-1-[4-(aminomethyl)-2-keto-chromene-3-carbonyl]pentyl]-2-[(2-amino-3-methyl-butanoyl)amino]-4-methyl-valeramide Formula: C27H41N5O5 MolecularWeight: 515.64494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CCCCN)C(=O)C1=C(C2=CC=CC=C2OC1=O)CN)NC(=O)C(C(C)C)N

Isomeric SMILES

CC(C)CC(C(=O)NC(CCCCN)C(=O)C1=C(C2=CC=CC=C2OC1=O)CN)NC(=O)C(C(C)C)N

InChI

InChI=1S/C27H41N5O5/c1-15(2)13-20(32-26(35)23(30)16(3)4)25(34)31-19(10-7-8-12-28)24(33)22-18(14-29)17-9-5-6-11-21(17)37-27(22)36/h5-6,9,11,15-16,19-20,23H,7-8,10,12-14,28-30H2,1-4H3,(H,31,34)(H,32,35)