N-(1-azanyl-9-oxidanylidene-thioxanthen-4-yl)-4-(dimethylamino)-N-methyl-butane-1-sulfonamide

Systemtic Name: N-(1-azanyl-9-oxidanylidene-thioxanthen-4-yl)-4-(dimethylamino)-N-methyl-butane-1-sulfonamide Openeye Name: N-(1-amino-9-oxo-thioxanthen-4-yl)-4-(dimethylamino)-N-methyl-butane-1-sulfonamide CAS Name: N-(1-amino-9-oxo-4-thioxanthenyl)-4-(dimethylamino)-N-methyl-1-butanesulfonamide IUPAC Name: N-(1-amino-9-oxothioxanthen-4-yl)-4-(dimethylamino)-N-methylbutane-1-sulfonamide Traditional Name: N-(1-amino-9-keto-thioxanthen-4-yl)-4-(dimethylamino)-N-methyl-butane-1-sulfonamide Formula: C20H25N3O3S2 MolecularWeight: 419.5608

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCCS(=O)(=O)N(C)C1=C2C(=C(C=C1)N)C(=O)C3=CC=CC=C3S2

Isomeric SMILES

CN(C)CCCCS(=O)(=O)N(C)C1=C2C(=C(C=C1)N)C(=O)C3=CC=CC=C3S2

InChI

InChI=1S/C20H25N3O3S2/c1-22(2)12-6-7-13-28(25,26)23(3)16-11-10-15(21)18-19(24)14-8-4-5-9-17(14)27-20(16)18/h4-5,8-11H,6-7,12-13,21H2,1-3H3