N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(3-oxidanylidenepiperazin-1-yl)propanamide

Systemtic Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(3-oxidanylidenepiperazin-1-yl)propanamide Openeye Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-(3-oxopiperazin-1-yl)propanamide CAS Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(3-oxo-1-piperazinyl)propanamide IUPAC Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(3-oxopiperazin-1-yl)propanamide Traditional Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-(3-ketopiperazino)propionamide Formula: C17H22N4O2S MolecularWeight: 346.44718

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)CCN3CCNC(=O)C3

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)CCN3CCNC(=O)C3

InChI

InChI=1S/C17H22N4O2S/c1-11-2-3-12-13(9-18)17(24-14(12)8-11)20-15(22)4-6-21-7-5-19-16(23)10-21/h11H,2-8,10H2,1H3,(H,19,23)(H,20,22)