(2S)-2-methyl-3-oxidanylidene-N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]-4H-1,4-benzothiazine-6-carboxamide

Systemtic Name: (2S)-2-methyl-3-oxidanylidene-N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]-4H-1,4-benzothiazine-6-carboxamide Openeye Name: (2S)-N-[4-(4-benzylpiperazin-1-yl)phenyl]-2-methyl-3-oxo-4H-1,4-benzothiazine-6-carboxamide CAS Name: (2S)-2-methyl-3-oxo-N-[4-[4-(phenylmethyl)-1-piperazinyl]phenyl]-4H-1,4-benzothiazine-6-carboxamide IUPAC Name: (2S)-N-[4-(4-benzylpiperazin-1-yl)phenyl]-2-methyl-3-oxo-4H-1,4-benzothiazine-6-carboxamide Traditional Name: (2S)-N-[4-(4-benzylpiperazino)phenyl]-3-keto-2-methyl-4H-1,4-benzothiazine-6-carboxamide Formula: C27H28N4O2S MolecularWeight: 472.60182

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(S1)C=CC(=C2)C(=O)NC3=CC=C(C=C3)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

C[C@H]1C(=O)NC2=C(S1)C=CC(=C2)C(=O)NC3=CC=C(C=C3)N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C27H28N4O2S/c1-19-26(32)29-24-17-21(7-12-25(24)34-19)27(33)28-22-8-10-23(11-9-22)31-15-13-30(14-16-31)18-20-5-3-2-4-6-20/h2-12,17,19H,13-16,18H2,1H3,(H,28,33)(H,29,32)/t19-/m0/s1