5-ethyl-4-oxidanylidene-N-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]thieno[3,2-c]quinoline-2-carboxamide

Systemtic Name: 5-ethyl-4-oxidanylidene-N-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]thieno[3,2-c]quinoline-2-carboxamide Openeye Name: N-[2-(4-benzylpiperazin-1-yl)ethyl]-5-ethyl-4-oxo-thieno[3,2-c]quinoline-2-carboxamide CAS Name: 5-ethyl-4-oxo-N-[2-[4-(phenylmethyl)-1-piperazinyl]ethyl]-2-thieno[3,2-c]quinolinecarboxamide IUPAC Name: N-[2-(4-benzylpiperazin-1-yl)ethyl]-5-ethyl-4-oxothieno[3,2-c]quinoline-2-carboxamide Traditional Name: N-[2-(4-benzylpiperazino)ethyl]-5-ethyl-4-keto-thieno[3,2-c]quinoline-2-carboxamide Formula: C27H30N4O2S MolecularWeight: 474.6177

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2C3=C(C1=O)C=C(S3)C(=O)NCCN4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CCN1C2=CC=CC=C2C3=C(C1=O)C=C(S3)C(=O)NCCN4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C27H30N4O2S/c1-2-31-23-11-7-6-10-21(23)25-22(27(31)33)18-24(34-25)26(32)28-12-13-29-14-16-30(17-15-29)19-20-8-4-3-5-9-20/h3-11,18H,2,12-17,19H2,1H3,(H,28,32)