2-(4,5-dihydro-1H-imidazol-2-yl)-6-methyl-4-(phenylmethyl)-2,3-dihydro-1,4-benzothiazine; ethanedioic acid

Systemtic Name: 2-(4,5-dihydro-1H-imidazol-2-yl)-6-methyl-4-(phenylmethyl)-2,3-dihydro-1,4-benzothiazine; ethanedioic acid Openeye Name: 4-benzyl-2-(4,5-dihydro-1H-imidazol-2-yl)-6-methyl-2,3-dihydro-1,4-benzothiazine; oxalic acid CAS Name: 2-(4,5-dihydro-1H-imidazol-2-yl)-6-methyl-4-(phenylmethyl)-2,3-dihydro-1,4-benzothiazine; oxalic acid IUPAC Name: 4-benzyl-2-(4,5-dihydro-1H-imidazol-2-yl)-6-methyl-2,3-dihydro-1,4-benzothiazine; oxalic acid Traditional Name: 4-benzyl-2-(2-imidazolin-2-yl)-6-methyl-2,3-dihydro-1,4-benzothiazine; oxalic acid Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC(CN2CC3=CC=CC=C3)C4=NCCN4.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC2=C(C=C1)SC(CN2CC3=CC=CC=C3)C4=NCCN4.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H21N3S.C2H2O4/c1-14-7-8-17-16(11-14)22(12-15-5-3-2-4-6-15)13-18(23-17)19-20-9-10-21-19;3-1(4)2(5)6/h2-8,11,18H,9-10,12-13H2,1H3,(H,20,21);(H,3,4)(H,5,6)