2-[2-[3-(dimethylamino)propoxy]-5-methoxy-phenyl]-4,7-dimethyl-1,4-benzothiazin-3-one

Systemtic Name: 2-[2-[3-(dimethylamino)propoxy]-5-methoxy-phenyl]-4,7-dimethyl-1,4-benzothiazin-3-one Openeye Name: 2-[2-[3-(dimethylamino)propoxy]-5-methoxy-phenyl]-4,7-dimethyl-1,4-benzothiazin-3-one CAS Name: 2-[2-[3-(dimethylamino)propoxy]-5-methoxyphenyl]-4,7-dimethyl-1,4-benzothiazin-3-one IUPAC Name: 2-[2-[3-(dimethylamino)propoxy]-5-methoxyphenyl]-4,7-dimethyl-1,4-benzothiazin-3-one Traditional Name: 2-[2-[3-(dimethylamino)propoxy]-5-methoxy-phenyl]-4,7-dimethyl-1,4-benzothiazin-3-one Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)C(S2)C3=C(C=CC(=C3)OC)OCCCN(C)C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)C(S2)C3=C(C=CC(=C3)OC)OCCCN(C)C)C

InChI

InChI=1S/C22H28N2O3S/c1-15-7-9-18-20(13-15)28-21(22(25)24(18)4)17-14-16(26-5)8-10-19(17)27-12-6-11-23(2)3/h7-10,13-14,21H,6,11-12H2,1-5H3