1-[4-(4-cyano-2-nitro-phenyl)-1,4-thiazinan-1-ylidene]-3-phenyl-urea

Systemtic Name: 1-[4-(4-cyano-2-nitro-phenyl)-1,4-thiazinan-1-ylidene]-3-phenyl-urea Openeye Name: 1-[4-(4-cyano-2-nitro-phenyl)-1,4-thiazinan-1-ylidene]-3-phenyl-urea CAS Name: 1-[4-(4-cyano-2-nitrophenyl)-1,4-thiazinan-1-ylidene]-3-phenylurea IUPAC Name: 1-[4-(4-cyano-2-nitrophenyl)-1,4-thiazinan-1-ylidene]-3-phenylurea Traditional Name: 1-[4-(4-cyano-2-nitro-phenyl)-1,4-thiazinan-1-ylidene]-3-phenyl-urea Formula: C18H17N5O3S MolecularWeight: 383.42428

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=NC(=O)NC2=CC=CC=C2)CCN1C3=C(C=C(C=C3)C#N)[N+](=O)[O-]

Isomeric SMILES

C1CS(=NC(=O)NC2=CC=CC=C2)CCN1C3=C(C=C(C=C3)C#N)[N+](=O)[O-]

InChI

InChI=1S/C18H17N5O3S/c19-13-14-6-7-16(17(12-14)23(25)26)22-8-10-27(11-9-22)21-18(24)20-15-4-2-1-3-5-15/h1-7,12H,8-11H2,(H,20,24)