N-[1-(3-azanylpropylamino)-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]-2-methyl-3-(7-oxidanylidene-3,6-dihydro-2H-azepin-1-yl)propanamide

Systemtic Name: N-[1-(3-azanylpropylamino)-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]-2-methyl-3-(7-oxidanylidene-3,6-dihydro-2H-azepin-1-yl)propanamide Openeye Name: N-[2-(3-aminopropylamino)-1-(2-naphthylmethyl)-2-oxo-ethyl]-2-methyl-3-(7-oxo-3,6-dihydro-2H-azepin-1-yl)propanamide CAS Name: N-[1-(3-aminopropylamino)-3-(2-naphthalenyl)-1-oxopropan-2-yl]-2-methyl-3-(7-oxo-3,6-dihydro-2H-azepin-1-yl)propanamide IUPAC Name: N-[1-(3-aminopropylamino)-3-naphthalen-2-yl-1-oxopropan-2-yl]-2-methyl-3-(7-oxo-3,6-dihydro-2H-azepin-1-yl)propanamide Traditional Name: N-[2-(3-aminopropylamino)-2-keto-1-(2-naphthylmethyl)ethyl]-3-(7-keto-3,6-dihydro-2H-azepin-1-yl)-2-methyl-propionamide Formula: C26H34N4O3 MolecularWeight: 450.57316

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1CCC=CCC1=O)C(=O)NC(CC2=CC3=CC=CC=C3C=C2)C(=O)NCCCN

Isomeric SMILES

CC(CN1CCC=CCC1=O)C(=O)NC(CC2=CC3=CC=CC=C3C=C2)C(=O)NCCCN

InChI

InChI=1S/C26H34N4O3/c1-19(18-30-15-6-2-3-10-24(30)31)25(32)29-23(26(33)28-14-7-13-27)17-20-11-12-21-8-4-5-9-22(21)16-20/h2-5,8-9,11-12,16,19,23H,6-7,10,13-15,17-18,27H2,1H3,(H,28,33)(H,29,32)