N-[4-(1-imidazol-1-yl-4-naphthalen-1-yl-butan-2-yl)sulfanylphenyl]methanamide

Systemtic Name: N-[4-(1-imidazol-1-yl-4-naphthalen-1-yl-butan-2-yl)sulfanylphenyl]methanamide Openeye Name: N-[4-[1-(imidazol-1-ylmethyl)-3-(1-naphthyl)propyl]sulfanylphenyl]formamide CAS Name: N-[4-[[1-(1-imidazolyl)-4-(1-naphthalenyl)butan-2-yl]thio]phenyl]formamide IUPAC Name: N-[4-(1-imidazol-1-yl-4-naphthalen-1-ylbutan-2-yl)sulfanylphenyl]formamide Traditional Name: N-[4-[[1-(imidazol-1-ylmethyl)-3-(1-naphthyl)propyl]thio]phenyl]formamide Formula: C24H23N3OS MolecularWeight: 401.52392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CCC(CN3C=CN=C3)SC4=CC=C(C=C4)NC=O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CCC(CN3C=CN=C3)SC4=CC=C(C=C4)NC=O

InChI

InChI=1S/C24H23N3OS/c28-18-26-21-9-12-22(13-10-21)29-23(16-27-15-14-25-17-27)11-8-20-6-3-5-19-4-1-2-7-24(19)20/h1-7,9-10,12-15,17-18,23H,8,11,16H2,(H,26,28)