N-[4-(azepan-1-ylsulfonyl)phenyl]-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-keto-4H-1,4-benzothiazine-6-carboxamide Formula: C21H23N3O4S2 MolecularWeight: 445.55502

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC4=C(C=C3)SCC(=O)N4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC4=C(C=C3)SCC(=O)N4

InChI

InChI=1S/C21H23N3O4S2/c25-20-14-29-19-10-5-15(13-18(19)23-20)21(26)22-16-6-8-17(9-7-16)30(27,28)24-11-3-1-2-4-12-24/h5-10,13H,1-4,11-12,14H2,(H,22,26)(H,23,25)