N-(3-cyanothiophen-2-yl)-3-[4-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]propanamide

Systemtic Name: N-(3-cyanothiophen-2-yl)-3-[4-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]propanamide Openeye Name: N-(3-cyano-2-thienyl)-3-[4-[2-(cyclopropylamino)-2-oxo-ethyl]piperazin-1-yl]propanamide CAS Name: N-(3-cyano-2-thiophenyl)-3-[4-[2-(cyclopropylamino)-2-oxoethyl]-1-piperazinyl]propanamide IUPAC Name: N-(3-cyanothiophen-2-yl)-3-[4-[2-(cyclopropylamino)-2-oxoethyl]piperazin-1-yl]propanamide Traditional Name: N-(3-cyano-2-thienyl)-3-[4-[2-(cyclopropylamino)-2-keto-ethyl]piperazino]propionamide Formula: C17H23N5O2S MolecularWeight: 361.46182

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)CN2CCN(CC2)CCC(=O)NC3=C(C=CS3)C#N

Isomeric SMILES

C1CC1NC(=O)CN2CCN(CC2)CCC(=O)NC3=C(C=CS3)C#N

InChI

InChI=1S/C17H23N5O2S/c18-11-13-4-10-25-17(13)20-15(23)3-5-21-6-8-22(9-7-21)12-16(24)19-14-1-2-14/h4,10,14H,1-3,5-9,12H2,(H,19,24)(H,20,23)