5-[(2E)-2-[(3-iodanylphenyl)methylidene]hydrazinyl]-3-(phenylmethylsulfanyl)-1,2-thiazole-4-carbonitrile

Systemtic Name: 5-[(2E)-2-[(3-iodanylphenyl)methylidene]hydrazinyl]-3-(phenylmethylsulfanyl)-1,2-thiazole-4-carbonitrile Openeye Name: 3-benzylsulfanyl-5-[(2E)-2-[(3-iodophenyl)methylene]hydrazino]isothiazole-4-carbonitrile CAS Name: 5-[(2E)-2-[(3-iodophenyl)methylidene]hydrazinyl]-3-(phenylmethylthio)-4-isothiazolecarbonitrile IUPAC Name: 3-benzylsulfanyl-5-[(2E)-2-[(3-iodophenyl)methylidene]hydrazinyl]-1,2-thiazole-4-carbonitrile Traditional Name: 3-(benzylthio)-5-[(N'E)-N'-(3-iodobenzylidene)hydrazino]isothiazole-4-carbonitrile Formula: C18H13IN4S2 MolecularWeight: 476.35709

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NSC(=C2C#N)NN=CC3=CC(=CC=C3)I

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NSC(=C2C#N)N/N=C/C3=CC(=CC=C3)I

InChI

InChI=1S/C18H13IN4S2/c19-15-8-4-7-14(9-15)11-21-22-17-16(10-20)18(23-25-17)24-12-13-5-2-1-3-6-13/h1-9,11,22H,12H2/b21-11+