2-[3-(4-tert-butylphenoxy)phenyl]-3-(2-piperidin-1-ylethyl)-2H-1,3-benzothiazin-4-one

Systemtic Name: 2-[3-(4-tert-butylphenoxy)phenyl]-3-(2-piperidin-1-ylethyl)-2H-1,3-benzothiazin-4-one Openeye Name: 2-[3-(4-tert-butylphenoxy)phenyl]-3-[2-(1-piperidyl)ethyl]-2H-1,3-benzothiazin-4-one CAS Name: 2-[3-(4-tert-butylphenoxy)phenyl]-3-[2-(1-piperidinyl)ethyl]-2H-1,3-benzothiazin-4-one IUPAC Name: 2-[3-(4-tert-butylphenoxy)phenyl]-3-(2-piperidin-1-ylethyl)-2H-1,3-benzothiazin-4-one Traditional Name: 2-[3-(4-tert-butylphenoxy)phenyl]-3-(2-piperidinoethyl)-2H-1,3-benzothiazin-4-one Formula: C31H36N2O2S MolecularWeight: 500.69474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OC2=CC=CC(=C2)C3N(C(=O)C4=CC=CC=C4S3)CCN5CCCCC5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OC2=CC=CC(=C2)C3N(C(=O)C4=CC=CC=C4S3)CCN5CCCCC5

InChI

InChI=1S/C31H36N2O2S/c1-31(2,3)24-14-16-25(17-15-24)35-26-11-9-10-23(22-26)30-33(21-20-32-18-7-4-8-19-32)29(34)27-12-5-6-13-28(27)36-30/h5-6,9-17,22,30H,4,7-8,18-21H2,1-3H3