4-[4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-4-oxidanylidene-butanenitrile

Systemtic Name: 4-[4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-4-oxidanylidene-butanenitrile Openeye Name: 4-[4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-4-oxo-butanenitrile CAS Name: 4-[4-(6-ethyl-4-thieno[2,3-d]pyrimidinyl)-1-piperazinyl]-4-oxobutanenitrile IUPAC Name: 4-[4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-4-oxobutanenitrile Traditional Name: 4-[4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazino]-4-keto-butyronitrile Formula: C16H19N5OS MolecularWeight: 329.41996

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N=CN=C2S1)N3CCN(CC3)C(=O)CCC#N

Isomeric SMILES

CCC1=CC2=C(N=CN=C2S1)N3CCN(CC3)C(=O)CCC#N

InChI

InChI=1S/C16H19N5OS/c1-2-12-10-13-15(18-11-19-16(13)23-12)21-8-6-20(7-9-21)14(22)4-3-5-17/h10-11H,2-4,6-9H2,1H3