N-(1-azanyl-7-methoxy-9-oxidanylidene-thioxanthen-4-yl)-3-(diethylamino)-N-methyl-propanamide

Systemtic Name: N-(1-azanyl-7-methoxy-9-oxidanylidene-thioxanthen-4-yl)-3-(diethylamino)-N-methyl-propanamide Openeye Name: N-(1-amino-7-methoxy-9-oxo-thioxanthen-4-yl)-3-(diethylamino)-N-methyl-propanamide CAS Name: N-(1-amino-7-methoxy-9-oxo-4-thioxanthenyl)-3-(diethylamino)-N-methylpropanamide IUPAC Name: N-(1-amino-7-methoxy-9-oxothioxanthen-4-yl)-3-(diethylamino)-N-methylpropanamide Traditional Name: N-(1-amino-9-keto-7-methoxy-thioxanthen-4-yl)-3-(diethylamino)-N-methyl-propionamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCC(=O)N(C)C1=C2C(=C(C=C1)N)C(=O)C3=C(S2)C=CC(=C3)OC

Isomeric SMILES

CCN(CC)CCC(=O)N(C)C1=C2C(=C(C=C1)N)C(=O)C3=C(S2)C=CC(=C3)OC

InChI

InChI=1S/C22H27N3O3S/c1-5-25(6-2)12-11-19(26)24(3)17-9-8-16(23)20-21(27)15-13-14(28-4)7-10-18(15)29-22(17)20/h7-10,13H,5-6,11-12,23H2,1-4H3