1-[4,5-dimethyl-3-[2-oxidanyl-3-(propylamino)propoxy]thiophen-2-yl]-3-phenyl-propan-1-one hydrochloride

Systemtic Name: 1-[4,5-dimethyl-3-[2-oxidanyl-3-(propylamino)propoxy]thiophen-2-yl]-3-phenyl-propan-1-one hydrochloride Openeye Name: 1-[3-[2-hydroxy-3-(propylamino)propoxy]-4,5-dimethyl-2-thienyl]-3-phenyl-propan-1-one hydrochloride CAS Name: 1-[3-[2-hydroxy-3-(propylamino)propoxy]-4,5-dimethyl-2-thiophenyl]-3-phenyl-1-propanone hydrochloride IUPAC Name: 1-[3-[2-hydroxy-3-(propylamino)propoxy]-4,5-dimethylthiophen-2-yl]-3-phenylpropan-1-one hydrochloride Traditional Name: 1-[3-[2-hydroxy-3-(propylamino)propoxy]-4,5-dimethyl-2-thienyl]-3-phenyl-propan-1-one hydrochloride Formula: C21H30ClNO3S MolecularWeight: 411.9858

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Descriptors Computed from Structure

Canonical SMILES:

CCCNCC(COC1=C(SC(=C1C)C)C(=O)CCC2=CC=CC=C2)O.Cl

Isomeric SMILES

CCCNCC(COC1=C(SC(=C1C)C)C(=O)CCC2=CC=CC=C2)O.Cl

InChI

InChI=1S/C21H29NO3S.ClH/c1-4-12-22-13-18(23)14-25-20-15(2)16(3)26-21(20)19(24)11-10-17-8-6-5-7-9-17;/h5-9,18,22-23H,4,10-14H2,1-3H3;1H