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

Systemtic Name: 1-[4-(4-methylphenyl)-2-(4-pyrrolidin-1-ylphenyl)sulfanyl-butyl]imidazole Openeye Name: 1-[4-(p-tolyl)-2-(4-pyrrolidin-1-ylphenyl)sulfanyl-butyl]imidazole CAS Name: 1-[4-(4-methylphenyl)-2-[[4-(1-pyrrolidinyl)phenyl]thio]butyl]imidazole IUPAC Name: 1-[4-(4-methylphenyl)-2-(4-pyrrolidin-1-ylphenyl)sulfanylbutyl]imidazole Traditional Name: 1-[4-(p-tolyl)-2-[(4-pyrrolidinophenyl)thio]butyl]imidazole Formula: C24H29N3S MolecularWeight: 391.57216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCC(CN2C=CN=C2)SC3=CC=C(C=C3)N4CCCC4

Isomeric SMILES

CC1=CC=C(C=C1)CCC(CN2C=CN=C2)SC3=CC=C(C=C3)N4CCCC4

InChI

InChI=1S/C24H29N3S/c1-20-4-6-21(7-5-20)8-11-24(18-26-17-14-25-19-26)28-23-12-9-22(10-13-23)27-15-2-3-16-27/h4-7,9-10,12-14,17,19,24H,2-3,8,11,15-16,18H2,1H3