1-(2-diethylaminoethylamino)-4-[2-(2-hydroxyethylamino)ethylamino]-6-methoxy-thioxanthen-9-one

Systemtic Name: 1-(2-diethylaminoethylamino)-4-[2-(2-hydroxyethylamino)ethylamino]-6-methoxy-thioxanthen-9-one Openeye Name: 1-(2-diethylaminoethylamino)-4-[2-(2-hydroxyethylamino)ethylamino]-6-methoxy-thioxanthen-9-one CAS Name: 1-(2-diethylaminoethylamino)-4-[2-(2-hydroxyethylamino)ethylamino]-6-methoxy-9-thioxanthenone IUPAC Name: 1-(2-diethylaminoethylamino)-4-[2-(2-hydroxyethylamino)ethylamino]-6-methoxythioxanthen-9-one Traditional Name: 1-(2-diethylaminoethylamino)-4-[2-(2-hydroxyethylamino)ethylamino]-6-methoxy-thioxanthen-9-one Formula: C24H34N4O3S MolecularWeight: 458.61676

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H34N4O3S/c1-4-28(5-2)14-12-27-19-8-9-20(26-11-10-25-13-15-29)24-22(19)23(30)18-7-6-17(31-3)16-21(18)32-24/h6-9,16,25-27,29H,4-5,10-15H2,1-3H3