3-[(4-methyl-9H-xanthen-9-yl)sulfanyl]propan-1-amine hydrochloride

Systemtic Name: 3-[(4-methyl-9H-xanthen-9-yl)sulfanyl]propan-1-amine hydrochloride Openeye Name: 3-[(4-methyl-9H-xanthen-9-yl)sulfanyl]propan-1-amine hydrochloride CAS Name: 3-[(4-methyl-9H-xanthen-9-yl)thio]-1-propanamine hydrochloride IUPAC Name: 3-[(4-methyl-9H-xanthen-9-yl)sulfanyl]propan-1-amine hydrochloride Traditional Name: 3-[(4-methyl-9H-xanthen-9-yl)thio]propylamine hydrochloride Formula: C17H20ClNOS MolecularWeight: 321.8648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1OC3=CC=CC=C3C2SCCCN.Cl

Isomeric SMILES

CC1=CC=CC2=C1OC3=CC=CC=C3C2SCCCN.Cl

InChI

InChI=1S/C17H19NOS.ClH/c1-12-6-4-8-14-16(12)19-15-9-3-2-7-13(15)17(14)20-11-5-10-18;/h2-4,6-9,17H,5,10-11,18H2,1H3;1H