1-[4-naphthalen-1-yl-2-(4-pyrrolidin-1-ylphenyl)sulfanyl-butyl]imidazole

Systemtic Name: 1-[4-naphthalen-1-yl-2-(4-pyrrolidin-1-ylphenyl)sulfanyl-butyl]imidazole Openeye Name: 1-[4-(1-naphthyl)-2-(4-pyrrolidin-1-ylphenyl)sulfanyl-butyl]imidazole CAS Name: 1-[4-(1-naphthalenyl)-2-[[4-(1-pyrrolidinyl)phenyl]thio]butyl]imidazole IUPAC Name: 1-[4-naphthalen-1-yl-2-(4-pyrrolidin-1-ylphenyl)sulfanylbutyl]imidazole Traditional Name: 1-[4-(1-naphthyl)-2-[(4-pyrrolidinophenyl)thio]butyl]imidazole Formula: C27H29N3S MolecularWeight: 427.60426

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=C(C=C2)SC(CCC3=CC=CC4=CC=CC=C43)CN5C=CN=C5

Isomeric SMILES

C1CCN(C1)C2=CC=C(C=C2)SC(CCC3=CC=CC4=CC=CC=C43)CN5C=CN=C5

InChI

InChI=1S/C27H29N3S/c1-2-9-27-22(6-1)7-5-8-23(27)10-13-26(20-29-19-16-28-21-29)31-25-14-11-24(12-15-25)30-17-3-4-18-30/h1-2,5-9,11-12,14-16,19,21,26H,3-4,10,13,17-18,20H2