3-chloranyl-5-[[(1-methylimidazol-2-yl)-phenyl-methyl]amino]-1,2-thiazole-4-carbonitrile

Systemtic Name: 3-chloranyl-5-[[(1-methylimidazol-2-yl)-phenyl-methyl]amino]-1,2-thiazole-4-carbonitrile Openeye Name: 3-chloro-5-[[(1-methylimidazol-2-yl)-phenyl-methyl]amino]isothiazole-4-carbonitrile CAS Name: 3-chloro-5-[[(1-methyl-2-imidazolyl)-phenylmethyl]amino]-4-isothiazolecarbonitrile IUPAC Name: 3-chloro-5-[[(1-methylimidazol-2-yl)-phenylmethyl]amino]-1,2-thiazole-4-carbonitrile Traditional Name: 3-chloro-5-[[(1-methylimidazol-2-yl)-phenyl-methyl]amino]isothiazole-4-carbonitrile Formula: C15H12ClN5S MolecularWeight: 329.80728

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(C2=CC=CC=C2)NC3=C(C(=NS3)Cl)C#N

Isomeric SMILES

CN1C=CN=C1C(C2=CC=CC=C2)NC3=C(C(=NS3)Cl)C#N

InChI

InChI=1S/C15H12ClN5S/c1-21-8-7-18-14(21)12(10-5-3-2-4-6-10)19-15-11(9-17)13(16)20-22-15/h2-8,12,19H,1H3