(2E)-2-(4-nitrophenyl)-2-[3-(phenylmethyl)-1,3-thiazinan-2-ylidene]ethanenitrile

Systemtic Name: (2E)-2-(4-nitrophenyl)-2-[3-(phenylmethyl)-1,3-thiazinan-2-ylidene]ethanenitrile Openeye Name: (2E)-2-(3-benzyl-1,3-thiazinan-2-ylidene)-2-(4-nitrophenyl)acetonitrile CAS Name: (2E)-2-(4-nitrophenyl)-2-[3-(phenylmethyl)-1,3-thiazinan-2-ylidene]acetonitrile IUPAC Name: (2E)-2-(3-benzyl-1,3-thiazinan-2-ylidene)-2-(4-nitrophenyl)acetonitrile Traditional Name: (2E)-2-(3-benzyl-1,3-thiazinan-2-ylidene)-2-(4-nitrophenyl)acetonitrile Formula: C19H17N3O2S MolecularWeight: 351.42218

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=C(C#N)C2=CC=C(C=C2)[N+](=O)[O-])SC1)CC3=CC=CC=C3

Isomeric SMILES

C1CN(/C(=C(\C#N)/C2=CC=C(C=C2)[N+](=O)[O-])/SC1)CC3=CC=CC=C3

InChI

InChI=1S/C19H17N3O2S/c20-13-18(16-7-9-17(10-8-16)22(23)24)19-21(11-4-12-25-19)14-15-5-2-1-3-6-15/h1-3,5-10H,4,11-12,14H2/b19-18-