N-[1-(4-methoxyphenyl)-3-methyl-butyl]-4-(4-methylphenyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: N-[1-(4-methoxyphenyl)-3-methyl-butyl]-4-(4-methylphenyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: N-[1-(4-methoxyphenyl)-3-methyl-butyl]-4-(p-tolylsulfonyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: N-[1-(4-methoxyphenyl)-3-methylbutyl]-4-(4-methylphenyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: N-[1-(4-methoxyphenyl)-3-methylbutyl]-4-(4-methylphenyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: N-[1-(4-methoxyphenyl)-3-methyl-butyl]-4-tosyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C28H32N2O5S MolecularWeight: 508.62908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC(OC3=CC=CC=C32)C(=O)NC(CC(C)C)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC(OC3=CC=CC=C32)C(=O)NC(CC(C)C)C4=CC=C(C=C4)OC

InChI

InChI=1S/C28H32N2O5S/c1-19(2)17-24(21-11-13-22(34-4)14-12-21)29-28(31)27-18-30(25-7-5-6-8-26(25)35-27)36(32,33)23-15-9-20(3)10-16-23/h5-16,19,24,27H,17-18H2,1-4H3,(H,29,31)