3-azanyl-4-phenyl-1-(thiophen-3-ylmethylsulfanyl)butan-2-one hydrochloride

Systemtic Name: 3-azanyl-4-phenyl-1-(thiophen-3-ylmethylsulfanyl)butan-2-one hydrochloride Openeye Name: 3-amino-4-phenyl-1-(3-thienylmethylsulfanyl)butan-2-one hydrochloride CAS Name: 3-amino-4-phenyl-1-(3-thiophenylmethylthio)-2-butanone hydrochloride IUPAC Name: 3-amino-4-phenyl-1-(thiophen-3-ylmethylsulfanyl)butan-2-one hydrochloride Traditional Name: 3-amino-4-phenyl-1-(3-thenylthio)butan-2-one hydrochloride Formula: C15H18ClNOS2 MolecularWeight: 327.89252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)CSCC2=CSC=C2)N.Cl

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)CSCC2=CSC=C2)N.Cl

InChI

InChI=1S/C15H17NOS2.ClH/c16-14(8-12-4-2-1-3-5-12)15(17)11-19-10-13-6-7-18-9-13;/h1-7,9,14H,8,10-11,16H2;1H