[1-(2-diethylaminoethylamino)-9-oxidanylidene-thioxanthen-4-yl]methyl N-propylcarbamate

Systemtic Name: [1-(2-diethylaminoethylamino)-9-oxidanylidene-thioxanthen-4-yl]methyl N-propylcarbamate Openeye Name: [1-(2-diethylaminoethylamino)-9-oxo-thioxanthen-4-yl]methyl N-propylcarbamate CAS Name: N-propylcarbamic acid [1-(2-diethylaminoethylamino)-9-oxo-4-thioxanthenyl]methyl ester IUPAC Name: [1-(2-diethylaminoethylamino)-9-oxothioxanthen-4-yl]methyl N-propylcarbamate Traditional Name: N-propylcarbamic acid [1-(2-diethylaminoethylamino)-9-keto-thioxanthen-4-yl]methyl ester Formula: C24H31N3O3S MolecularWeight: 441.58624

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)OCC1=C2C(=C(C=C1)NCCN(CC)CC)C(=O)C3=CC=CC=C3S2

Isomeric SMILES

CCCNC(=O)OCC1=C2C(=C(C=C1)NCCN(CC)CC)C(=O)C3=CC=CC=C3S2

InChI

InChI=1S/C24H31N3O3S/c1-4-13-26-24(29)30-16-17-11-12-19(25-14-15-27(5-2)6-3)21-22(28)18-9-7-8-10-20(18)31-23(17)21/h7-12,25H,4-6,13-16H2,1-3H3,(H,26,29)