N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-3-oxidanylidene-N-propyl-4H-1,4-benzothiazine-6-carboxamide

Systemtic Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-3-oxidanylidene-N-propyl-4H-1,4-benzothiazine-6-carboxamide Openeye Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-3-oxo-N-propyl-4H-1,4-benzothiazine-6-carboxamide CAS Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-3-oxo-N-propyl-4H-1,4-benzothiazine-6-carboxamide IUPAC Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-3-oxo-N-propyl-4H-1,4-benzothiazine-6-carboxamide Traditional Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-3-keto-N-propyl-4H-1,4-benzothiazine-6-carboxamide Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1COC2=CC=CC=C2O1)C(=O)C3=CC4=C(C=C3)SCC(=O)N4

Isomeric SMILES

CCCN(C[C@H]1COC2=CC=CC=C2O1)C(=O)C3=CC4=C(C=C3)SCC(=O)N4

InChI

InChI=1S/C21H22N2O4S/c1-2-9-23(11-15-12-26-17-5-3-4-6-18(17)27-15)21(25)14-7-8-19-16(10-14)22-20(24)13-28-19/h3-8,10,15H,2,9,11-13H2,1H3,(H,22,24)/t15-/m0/s1