(2S)-6-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]carbonyl-2-methyl-4H-1,4-benzothiazin-3-one

Systemtic Name: (2S)-6-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]carbonyl-2-methyl-4H-1,4-benzothiazin-3-one Openeye Name: (2S)-6-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]-2-methyl-4H-1,4-benzothiazin-3-one CAS Name: (2S)-6-[[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-oxomethyl]-2-methyl-4H-1,4-benzothiazin-3-one IUPAC Name: (2S)-6-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]-2-methyl-4H-1,4-benzothiazin-3-one Traditional Name: (2S)-6-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]-2-methyl-4H-1,4-benzothiazin-3-one Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(S1)C=CC(=C2)C(=O)N3CCC(CC3)C(=O)N4CCCCCC4

Isomeric SMILES

C[C@H]1C(=O)NC2=C(S1)C=CC(=C2)C(=O)N3CCC(CC3)C(=O)N4CCCCCC4

InChI

InChI=1S/C22H29N3O3S/c1-15-20(26)23-18-14-17(6-7-19(18)29-15)22(28)25-12-8-16(9-13-25)21(27)24-10-4-2-3-5-11-24/h6-7,14-16H,2-5,8-13H2,1H3,(H,23,26)/t15-/m0/s1