3-bromanyl-5-[[4-(pyridin-4-ylmethyl)phenyl]amino]-1,2-thiazole-4-carbonitrile

Systemtic Name: 3-bromanyl-5-[[4-(pyridin-4-ylmethyl)phenyl]amino]-1,2-thiazole-4-carbonitrile Openeye Name: 3-bromo-5-[4-(4-pyridylmethyl)anilino]isothiazole-4-carbonitrile CAS Name: 3-bromo-5-[4-(pyridin-4-ylmethyl)anilino]-4-isothiazolecarbonitrile IUPAC Name: 3-bromo-5-[4-(pyridin-4-ylmethyl)anilino]-1,2-thiazole-4-carbonitrile Traditional Name: 3-bromo-5-[4-(4-pyridylmethyl)anilino]isothiazole-4-carbonitrile Formula: C16H11BrN4S MolecularWeight: 371.25434

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC2=CC=NC=C2)NC3=C(C(=NS3)Br)C#N

Isomeric SMILES

C1=CC(=CC=C1CC2=CC=NC=C2)NC3=C(C(=NS3)Br)C#N

InChI

InChI=1S/C16H11BrN4S/c17-15-14(10-18)16(22-21-15)20-13-3-1-11(2-4-13)9-12-5-7-19-8-6-12/h1-8,20H,9H2