4-[4-[4-(benzotriazol-1-yloxy)butanoyl]piperazin-1-yl]-6-ethyl-thieno[2,3-d]pyrimidine-2-carbonitrile

Systemtic Name: 4-[4-[4-(benzotriazol-1-yloxy)butanoyl]piperazin-1-yl]-6-ethyl-thieno[2,3-d]pyrimidine-2-carbonitrile Openeye Name: 4-[4-[4-(benzotriazol-1-yloxy)butanoyl]piperazin-1-yl]-6-ethyl-thieno[2,3-d]pyrimidine-2-carbonitrile CAS Name: 4-[4-[4-(1-benzotriazolyloxy)-1-oxobutyl]-1-piperazinyl]-6-ethyl-2-thieno[2,3-d]pyrimidinecarbonitrile IUPAC Name: 4-[4-[4-(benzotriazol-1-yloxy)butanoyl]piperazin-1-yl]-6-ethylthieno[2,3-d]pyrimidine-2-carbonitrile Traditional Name: 4-[4-[4-(benzotriazol-1-yloxy)butanoyl]piperazino]-6-ethyl-thieno[2,3-d]pyrimidine-2-carbonitrile Formula: C23H24N8O2S MolecularWeight: 476.55406

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N=C(N=C2S1)C#N)N3CCN(CC3)C(=O)CCCON4C5=CC=CC=C5N=N4

Isomeric SMILES

CCC1=CC2=C(N=C(N=C2S1)C#N)N3CCN(CC3)C(=O)CCCON4C5=CC=CC=C5N=N4

InChI

InChI=1S/C23H24N8O2S/c1-2-16-14-17-22(25-20(15-24)26-23(17)34-16)30-11-9-29(10-12-30)21(32)8-5-13-33-31-19-7-4-3-6-18(19)27-28-31/h3-4,6-7,14H,2,5,8-13H2,1H3