6-tert-butyl-N-[[4-(3-methylpiperidin-1-yl)phenyl]methyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: 6-tert-butyl-N-[[4-(3-methylpiperidin-1-yl)phenyl]methyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: 6-tert-butyl-N-[[4-(3-methyl-1-piperidyl)phenyl]methyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: 6-tert-butyl-N-[[4-(3-methyl-1-piperidinyl)phenyl]methyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: 6-tert-butyl-N-[[4-(3-methylpiperidin-1-yl)phenyl]methyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 6-tert-butyl-4-mesyl-N-[4-(3-methylpiperidino)benzyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C27H37N3O4S MolecularWeight: 499.66538

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=CC=C(C=C2)CNC(=O)C3CN(C4=C(O3)C=CC(=C4)C(C)(C)C)S(=O)(=O)C

Isomeric SMILES

CC1CCCN(C1)C2=CC=C(C=C2)CNC(=O)C3CN(C4=C(O3)C=CC(=C4)C(C)(C)C)S(=O)(=O)C

InChI

InChI=1S/C27H37N3O4S/c1-19-7-6-14-29(17-19)22-11-8-20(9-12-22)16-28-26(31)25-18-30(35(5,32)33)23-15-21(27(2,3)4)10-13-24(23)34-25/h8-13,15,19,25H,6-7,14,16-18H2,1-5H3,(H,28,31)