5-ethyl-N-[[1-[(3-methylphenyl)methyl]piperidin-4-yl]methyl]-4-oxidanylidene-thieno[3,2-c]quinoline-2-carboxamide

Systemtic Name: 5-ethyl-N-[[1-[(3-methylphenyl)methyl]piperidin-4-yl]methyl]-4-oxidanylidene-thieno[3,2-c]quinoline-2-carboxamide Openeye Name: 5-ethyl-N-[[1-(m-tolylmethyl)-4-piperidyl]methyl]-4-oxo-thieno[3,2-c]quinoline-2-carboxamide CAS Name: 5-ethyl-N-[[1-[(3-methylphenyl)methyl]-4-piperidinyl]methyl]-4-oxo-2-thieno[3,2-c]quinolinecarboxamide IUPAC Name: 5-ethyl-N-[[1-[(3-methylphenyl)methyl]piperidin-4-yl]methyl]-4-oxothieno[3,2-c]quinoline-2-carboxamide Traditional Name: 5-ethyl-4-keto-N-[[1-(3-methylbenzyl)-4-piperidyl]methyl]thieno[3,2-c]quinoline-2-carboxamide Formula: C28H31N3O2S MolecularWeight: 473.62964

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2C3=C(C1=O)C=C(S3)C(=O)NCC4CCN(CC4)CC5=CC=CC(=C5)C

Isomeric SMILES

CCN1C2=CC=CC=C2C3=C(C1=O)C=C(S3)C(=O)NCC4CCN(CC4)CC5=CC=CC(=C5)C

InChI

InChI=1S/C28H31N3O2S/c1-3-31-24-10-5-4-9-22(24)26-23(28(31)33)16-25(34-26)27(32)29-17-20-11-13-30(14-12-20)18-21-8-6-7-19(2)15-21/h4-10,15-16,20H,3,11-14,17-18H2,1-2H3,(H,29,32)