4-(2-azanylpropan-2-yl)-3-methoxy-thioxanthen-9-one hydrochloride

Systemtic Name: 4-(2-azanylpropan-2-yl)-3-methoxy-thioxanthen-9-one hydrochloride Openeye Name: 4-(1-amino-1-methyl-ethyl)-3-methoxy-thioxanthen-9-one hydrochloride CAS Name: 4-(2-aminopropan-2-yl)-3-methoxy-9-thioxanthenone hydrochloride IUPAC Name: 4-(2-aminopropan-2-yl)-3-methoxythioxanthen-9-one hydrochloride Traditional Name: 4-(1-amino-1-methyl-ethyl)-3-methoxy-thioxanthen-9-one hydrochloride Formula: C17H18ClNO2S MolecularWeight: 335.84832

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=C(C=CC2=C1SC3=CC=CC=C3C2=O)OC)N.Cl

Isomeric SMILES

CC(C)(C1=C(C=CC2=C1SC3=CC=CC=C3C2=O)OC)N.Cl

InChI

InChI=1S/C17H17NO2S.ClH/c1-17(2,18)14-12(20-3)9-8-11-15(19)10-6-4-5-7-13(10)21-16(11)14;/h4-9H,18H2,1-3H3;1H