4-[(2,5-dimethylphenyl)methyl]-N-[3-(dipropylamino)propyl]-3-oxidanylidene-1,4-benzothiazine-6-carboxamide

Systemtic Name: 4-[(2,5-dimethylphenyl)methyl]-N-[3-(dipropylamino)propyl]-3-oxidanylidene-1,4-benzothiazine-6-carboxamide Openeye Name: 4-[(2,5-dimethylphenyl)methyl]-N-[3-(dipropylamino)propyl]-3-oxo-1,4-benzothiazine-6-carboxamide CAS Name: 4-[(2,5-dimethylphenyl)methyl]-N-[3-(dipropylamino)propyl]-3-oxo-1,4-benzothiazine-6-carboxamide IUPAC Name: 4-[(2,5-dimethylphenyl)methyl]-N-[3-(dipropylamino)propyl]-3-oxo-1,4-benzothiazine-6-carboxamide Traditional Name: 4-(2,5-dimethylbenzyl)-N-[3-(dipropylamino)propyl]-3-keto-1,4-benzothiazine-6-carboxamide Formula: C27H37N3O2S MolecularWeight: 467.66658

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)CCCNC(=O)C1=CC2=C(C=C1)SCC(=O)N2CC3=C(C=CC(=C3)C)C

Isomeric SMILES

CCCN(CCC)CCCNC(=O)C1=CC2=C(C=C1)SCC(=O)N2CC3=C(C=CC(=C3)C)C

InChI

InChI=1S/C27H37N3O2S/c1-5-13-29(14-6-2)15-7-12-28-27(32)22-10-11-25-24(17-22)30(26(31)19-33-25)18-23-16-20(3)8-9-21(23)4/h8-11,16-17H,5-7,12-15,18-19H2,1-4H3,(H,28,32)