N-[(4-methylphenyl)-thiophen-2-yl-methyl]-2-(2-piperidin-1-ylcarbonyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethanamide

Systemtic Name: N-[(4-methylphenyl)-thiophen-2-yl-methyl]-2-(2-piperidin-1-ylcarbonyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethanamide Openeye Name: 2-[2-(piperidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazin-4-yl]-N-[p-tolyl(2-thienyl)methyl]acetamide CAS Name: N-[(4-methylphenyl)-thiophen-2-ylmethyl]-2-[2-[oxo(1-piperidinyl)methyl]-2,3-dihydro-1,4-benzoxazin-4-yl]acetamide IUPAC Name: N-[(4-methylphenyl)-thiophen-2-ylmethyl]-2-[2-(piperidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazin-4-yl]acetamide Traditional Name: 2-[2-(piperidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazin-4-yl]-N-[p-tolyl(2-thienyl)methyl]acetamide Formula: C28H31N3O3S MolecularWeight: 489.62904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CN3CC(OC4=CC=CC=C43)C(=O)N5CCCCC5

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CN3CC(OC4=CC=CC=C43)C(=O)N5CCCCC5

InChI

InChI=1S/C28H31N3O3S/c1-20-11-13-21(14-12-20)27(25-10-7-17-35-25)29-26(32)19-31-18-24(28(33)30-15-5-2-6-16-30)34-23-9-4-3-8-22(23)31/h3-4,7-14,17,24,27H,2,5-6,15-16,18-19H2,1H3,(H,29,32)