7-tert-butyl-2-[4-(2-methylpropoxy)phenyl]carbonyl-5,6,7,8-tetrahydro-4H-1,4-benzothiazine-3-carbonitrile

Systemtic Name: 7-tert-butyl-2-[4-(2-methylpropoxy)phenyl]carbonyl-5,6,7,8-tetrahydro-4H-1,4-benzothiazine-3-carbonitrile Openeye Name: 7-tert-butyl-2-(4-isobutoxybenzoyl)-5,6,7,8-tetrahydro-4H-1,4-benzothiazine-3-carbonitrile CAS Name: 7-tert-butyl-2-[[4-(2-methylpropoxy)phenyl]-oxomethyl]-5,6,7,8-tetrahydro-4H-1,4-benzothiazine-3-carbonitrile IUPAC Name: 7-tert-butyl-2-[4-(2-methylpropoxy)benzoyl]-5,6,7,8-tetrahydro-4H-1,4-benzothiazine-3-carbonitrile Traditional Name: 7-tert-butyl-2-(4-isobutoxybenzoyl)-5,6,7,8-tetrahydro-4H-1,4-benzothiazine-3-carbonitrile Formula: C24H30N2O2S MolecularWeight: 410.5722

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)C(=O)C2=C(NC3=C(S2)CC(CC3)C(C)(C)C)C#N

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)C(=O)C2=C(NC3=C(S2)CC(CC3)C(C)(C)C)C#N

InChI

InChI=1S/C24H30N2O2S/c1-15(2)14-28-18-9-6-16(7-10-18)22(27)23-20(13-25)26-19-11-8-17(24(3,4)5)12-21(19)29-23/h6-7,9-10,15,17,26H,8,11-12,14H2,1-5H3