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

Systemtic Name: N-[4-(1-imidazol-1-yl-4-phenyl-butan-2-yl)sulfanylphenyl]methanamide Openeye Name: N-[4-[1-(imidazol-1-ylmethyl)-3-phenyl-propyl]sulfanylphenyl]formamide CAS Name: N-[4-[[1-(1-imidazolyl)-4-phenylbutan-2-yl]thio]phenyl]formamide IUPAC Name: N-[4-(1-imidazol-1-yl-4-phenylbutan-2-yl)sulfanylphenyl]formamide Traditional Name: N-[4-[[1-(imidazol-1-ylmethyl)-3-phenyl-propyl]thio]phenyl]formamide Formula: C20H21N3OS MolecularWeight: 351.46524

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(CN2C=CN=C2)SC3=CC=C(C=C3)NC=O

Isomeric SMILES

C1=CC=C(C=C1)CCC(CN2C=CN=C2)SC3=CC=C(C=C3)NC=O

InChI

InChI=1S/C20H21N3OS/c24-16-22-18-7-10-19(11-8-18)25-20(14-23-13-12-21-15-23)9-6-17-4-2-1-3-5-17/h1-5,7-8,10-13,15-16,20H,6,9,14H2,(H,22,24)