4-[4-(diphenylmethylidene)piperidin-1-yl]-1-thiophen-2-yl-butan-1-one hydrochloride

Systemtic Name: 4-[4-(diphenylmethylidene)piperidin-1-yl]-1-thiophen-2-yl-butan-1-one hydrochloride Openeye Name: 4-(4-benzhydrylidene-1-piperidyl)-1-(2-thienyl)butan-1-one hydrochloride CAS Name: 4-[4-(diphenylmethylene)-1-piperidinyl]-1-thiophen-2-yl-1-butanone hydrochloride IUPAC Name: 4-(4-benzhydrylidenepiperidin-1-yl)-1-thiophen-2-ylbutan-1-one hydrochloride Traditional Name: 4-(4-benzhydrylidenepiperidino)-1-(2-thienyl)butan-1-one hydrochloride Formula: C26H28ClNOS MolecularWeight: 438.02462

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1=C(C2=CC=CC=C2)C3=CC=CC=C3)CCCC(=O)C4=CC=CS4.Cl

Isomeric SMILES

C1CN(CCC1=C(C2=CC=CC=C2)C3=CC=CC=C3)CCCC(=O)C4=CC=CS4.Cl

InChI

InChI=1S/C26H27NOS.ClH/c28-24(25-14-8-20-29-25)13-7-17-27-18-15-23(16-19-27)26(21-9-3-1-4-10-21)22-11-5-2-6-12-22;/h1-6,8-12,14,20H,7,13,15-19H2;1H