2-[[2-(4-bromophenyl)-1,3-thiazol-4-yl]methylsulfanyl]-4,6-dimethyl-pyridine-3-carbonitrile

Systemtic Name: 2-[[2-(4-bromophenyl)-1,3-thiazol-4-yl]methylsulfanyl]-4,6-dimethyl-pyridine-3-carbonitrile Openeye Name: 2-[[2-(4-bromophenyl)thiazol-4-yl]methylsulfanyl]-4,6-dimethyl-pyridine-3-carbonitrile CAS Name: 2-[[2-(4-bromophenyl)-4-thiazolyl]methylthio]-4,6-dimethyl-3-pyridinecarbonitrile IUPAC Name: 2-[[2-(4-bromophenyl)-1,3-thiazol-4-yl]methylsulfanyl]-4,6-dimethylpyridine-3-carbonitrile Traditional Name: 2-[[2-(4-bromophenyl)thiazol-4-yl]methylthio]-4,6-dimethyl-nicotinonitrile Formula: C18H14BrN3S2 MolecularWeight: 416.35786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SCC2=CSC(=N2)C3=CC=C(C=C3)Br)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SCC2=CSC(=N2)C3=CC=C(C=C3)Br)C

InChI

InChI=1S/C18H14BrN3S2/c1-11-7-12(2)21-18(16(11)8-20)24-10-15-9-23-17(22-15)13-3-5-14(19)6-4-13/h3-7,9H,10H2,1-2H3