methyl N-[[1-(2-diethylaminoethylamino)-6-methoxy-9-oxidanylidene-thioxanthen-4-yl]methyl]carbamate

Systemtic Name: methyl N-[[1-(2-diethylaminoethylamino)-6-methoxy-9-oxidanylidene-thioxanthen-4-yl]methyl]carbamate Openeye Name: methyl N-[[1-(2-diethylaminoethylamino)-6-methoxy-9-oxo-thioxanthen-4-yl]methyl]carbamate CAS Name: N-[[1-(2-diethylaminoethylamino)-6-methoxy-9-oxo-4-thioxanthenyl]methyl]carbamic acid methyl ester IUPAC Name: methyl N-[[1-(2-diethylaminoethylamino)-6-methoxy-9-oxothioxanthen-4-yl]methyl]carbamate Traditional Name: N-[[1-(2-diethylaminoethylamino)-9-keto-6-methoxy-thioxanthen-4-yl]methyl]carbamic acid methyl ester Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC1=C2C(=C(C=C1)CNC(=O)OC)SC3=C(C2=O)C=CC(=C3)OC

Isomeric SMILES

CCN(CC)CCNC1=C2C(=C(C=C1)CNC(=O)OC)SC3=C(C2=O)C=CC(=C3)OC

InChI

InChI=1S/C23H29N3O4S/c1-5-26(6-2)12-11-24-18-10-7-15(14-25-23(28)30-4)22-20(18)21(27)17-9-8-16(29-3)13-19(17)31-22/h7-10,13,24H,5-6,11-12,14H2,1-4H3,(H,25,28)