1-(2-diethylaminoethylamino)-4-(ethylaminomethyl)thioxanthen-9-one

Systemtic Name: 1-(2-diethylaminoethylamino)-4-(ethylaminomethyl)thioxanthen-9-one Openeye Name: 1-(2-diethylaminoethylamino)-4-(ethylaminomethyl)thioxanthen-9-one CAS Name: 1-(2-diethylaminoethylamino)-4-(ethylaminomethyl)-9-thioxanthenone IUPAC Name: 1-(2-diethylaminoethylamino)-4-(ethylaminomethyl)thioxanthen-9-one Traditional Name: 1-(2-diethylaminoethylamino)-4-(ethylaminomethyl)thioxanthen-9-one Formula: C22H29N3OS MolecularWeight: 383.55016

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC1=C2C(=C(C=C1)NCCN(CC)CC)C(=O)C3=CC=CC=C3S2

Isomeric SMILES

CCNCC1=C2C(=C(C=C1)NCCN(CC)CC)C(=O)C3=CC=CC=C3S2

InChI

InChI=1S/C22H29N3OS/c1-4-23-15-16-11-12-18(24-13-14-25(5-2)6-3)20-21(26)17-9-7-8-10-19(17)27-22(16)20/h7-12,23-24H,4-6,13-15H2,1-3H3