N-[2-[(2-azanyl-2-oxidanylidene-ethyl)-(3-methylbutyl)amino]-2-oxidanylidene-ethyl]-2-[2-(3,4-dimethoxyphenyl)ethylamino]-N-[2-(1-methylpyrrolidin-2-yl)ethyl]ethanamide

Systemtic Name: N-[2-[(2-azanyl-2-oxidanylidene-ethyl)-(3-methylbutyl)amino]-2-oxidanylidene-ethyl]-2-[2-(3,4-dimethoxyphenyl)ethylamino]-N-[2-(1-methylpyrrolidin-2-yl)ethyl]ethanamide Openeye Name: N-[2-[(2-amino-2-oxo-ethyl)-isopentyl-amino]-2-oxo-ethyl]-2-[2-(3,4-dimethoxyphenyl)ethylamino]-N-[2-(1-methylpyrrolidin-2-yl)ethyl]acetamide CAS Name: N-[2-[(2-amino-2-oxoethyl)-(3-methylbutyl)amino]-2-oxoethyl]-2-[2-(3,4-dimethoxyphenyl)ethylamino]-N-[2-(1-methyl-2-pyrrolidinyl)ethyl]acetamide IUPAC Name: N-[2-[(2-amino-2-oxoethyl)-(3-methylbutyl)amino]-2-oxoethyl]-2-[2-(3,4-dimethoxyphenyl)ethylamino]-N-[2-(1-methylpyrrolidin-2-yl)ethyl]acetamide Traditional Name: N-[2-[(2-amino-2-keto-ethyl)-isoamyl-amino]-2-keto-ethyl]-2-(homoveratrylamino)-N-[2-(1-methylpyrrolidin-2-yl)ethyl]acetamide Formula: C28H47N5O5 MolecularWeight: 533.70328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(CC(=O)N)C(=O)CN(CCC1CCCN1C)C(=O)CNCCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(C)CCN(CC(=O)N)C(=O)CN(CCC1CCCN1C)C(=O)CNCCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C28H47N5O5/c1-21(2)11-15-32(19-26(29)34)28(36)20-33(16-12-23-7-6-14-31(23)3)27(35)18-30-13-10-22-8-9-24(37-4)25(17-22)38-5/h8-9,17,21,23,30H,6-7,10-16,18-20H2,1-5H3,(H2,29,34)