N-cyclopentyl-2-(3-methylphenyl)-3-phenyl-1,2,4-thiadiazol-5-imine hydrobromide

Systemtic Name: N-cyclopentyl-2-(3-methylphenyl)-3-phenyl-1,2,4-thiadiazol-5-imine hydrobromide Openeye Name: N-cyclopentyl-2-(m-tolyl)-3-phenyl-1,2,4-thiadiazol-5-imine hydrobromide CAS Name: N-cyclopentyl-2-(3-methylphenyl)-3-phenyl-1,2,4-thiadiazol-5-imine hydrobromide IUPAC Name: N-cyclopentyl-2-(3-methylphenyl)-3-phenyl-1,2,4-thiadiazol-5-imine hydrobromide Traditional Name: cyclopentyl-[2-(m-tolyl)-3-phenyl-1,2,4-thiadiazol-5-ylidene]amine hydrobromide Formula: C20H22BrN3S MolecularWeight: 416.37778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=NC(=NC3CCCC3)S2)C4=CC=CC=C4.Br

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NC(=NC3CCCC3)S2)C4=CC=CC=C4.Br

InChI

InChI=1S/C20H21N3S.BrH/c1-15-8-7-13-18(14-15)23-19(16-9-3-2-4-10-16)22-20(24-23)21-17-11-5-6-12-17;/h2-4,7-10,13-14,17H,5-6,11-12H2,1H3;1H