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1-[3-(diethylamino)propylamino]-4-methyl-thioxanthen-9-one chloride

1-[3-(diethylamino)propylamino]-4-methyl-thioxanthen-9-one chloride

Systemtic Name:1-[3-(diethylamino)propylamino]-4-methyl-thioxanthen-9-one chloride
Openeye Name:1-[3-(diethylamino)propylamino]-4-methyl-thioxanthen-9-one chloride
CAS Name:1-[3-(diethylamino)propylamino]-4-methyl-9-thioxanthenone chloride
IUPAC Name:1-[3-(diethylamino)propylamino]-4-methylthioxanthen-9-one chloride
Traditional Name:1-[3-(diethylamino)propylamino]-4-methyl-thioxanthen-9-one chloride
Formula: C21H26ClN2OS-
MolecularWeight: 389.96194
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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCNC1=C2C(=C(C=C1)C)SC3=CC=CC=C3C2=O.[Cl-]


Isomeric SMILES

CCN(CC)CCCNC1=C2C(=C(C=C1)C)SC3=CC=CC=C3C2=O.[Cl-]


InChI

InChI=1S/C21H26N2OS.ClH/c1-4-23(5-2)14-8-13-22-17-12-11-15(3)21-19(17)20(24)16-9-6-7-10-18(16)25-21;/h6-7,9-12,22H,4-5,8,13-14H2,1-3H3;1H/p-1


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