N-(2-methylphenyl)-3-oxidanyl-4-[(4-thiophen-2-ylcarbonylpiperazin-1-yl)methyl]naphthalene-2-carboxamide

Systemtic Name: N-(2-methylphenyl)-3-oxidanyl-4-[(4-thiophen-2-ylcarbonylpiperazin-1-yl)methyl]naphthalene-2-carboxamide Openeye Name: 3-hydroxy-N-(o-tolyl)-4-[[4-(thiophene-2-carbonyl)piperazin-1-yl]methyl]naphthalene-2-carboxamide CAS Name: 3-hydroxy-N-(2-methylphenyl)-4-[[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]methyl]-2-naphthalenecarboxamide IUPAC Name: 3-hydroxy-N-(2-methylphenyl)-4-[[4-(thiophene-2-carbonyl)piperazin-1-yl]methyl]naphthalene-2-carboxamide Traditional Name: 3-hydroxy-N-(o-tolyl)-4-[[4-(2-thenoyl)piperazino]methyl]-2-naphthamide Formula: C28H27N3O3S MolecularWeight: 485.59728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3C(=C2O)CN4CCN(CC4)C(=O)C5=CC=CS5

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3C(=C2O)CN4CCN(CC4)C(=O)C5=CC=CS5

InChI

InChI=1S/C28H27N3O3S/c1-19-7-2-5-10-24(19)29-27(33)22-17-20-8-3-4-9-21(20)23(26(22)32)18-30-12-14-31(15-13-30)28(34)25-11-6-16-35-25/h2-11,16-17,32H,12-15,18H2,1H3,(H,29,33)