2-[4-[2-(cyclopropylamino)-2-oxidanylidene-ethanoyl]piperazin-1-yl]-N-(3,4-dimethoxyphenyl)propanamide

Systemtic Name: 2-[4-[2-(cyclopropylamino)-2-oxidanylidene-ethanoyl]piperazin-1-yl]-N-(3,4-dimethoxyphenyl)propanamide Openeye Name: 2-[4-[2-(cyclopropylamino)-2-oxo-acetyl]piperazin-1-yl]-N-(3,4-dimethoxyphenyl)propanamide CAS Name: 2-[4-[2-(cyclopropylamino)-1,2-dioxoethyl]-1-piperazinyl]-N-(3,4-dimethoxyphenyl)propanamide IUPAC Name: 2-[4-[2-(cyclopropylamino)-2-oxoacetyl]piperazin-1-yl]-N-(3,4-dimethoxyphenyl)propanamide Traditional Name: 2-[4-[2-(cyclopropylamino)-2-keto-acetyl]piperazino]-N-(3,4-dimethoxyphenyl)propionamide Formula: C20H28N4O5 MolecularWeight: 404.46012

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1)OC)OC)N2CCN(CC2)C(=O)C(=O)NC3CC3

Isomeric SMILES

CC(C(=O)NC1=CC(=C(C=C1)OC)OC)N2CCN(CC2)C(=O)C(=O)NC3CC3

InChI

InChI=1S/C20H28N4O5/c1-13(18(25)22-15-6-7-16(28-2)17(12-15)29-3)23-8-10-24(11-9-23)20(27)19(26)21-14-4-5-14/h6-7,12-14H,4-5,8-11H2,1-3H3,(H,21,26)(H,22,25)