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

Systemtic Name: 1-(4-chlorophenyl)-3-[4-(4-cyano-2-nitro-phenyl)-1,4-thiazinan-1-ylidene]urea Openeye Name: 1-(4-chlorophenyl)-3-[4-(4-cyano-2-nitro-phenyl)-1,4-thiazinan-1-ylidene]urea CAS Name: 1-(4-chlorophenyl)-3-[4-(4-cyano-2-nitrophenyl)-1,4-thiazinan-1-ylidene]urea IUPAC Name: 1-(4-chlorophenyl)-3-[4-(4-cyano-2-nitrophenyl)-1,4-thiazinan-1-ylidene]urea Traditional Name: 1-(4-chlorophenyl)-3-[4-(4-cyano-2-nitro-phenyl)-1,4-thiazinan-1-ylidene]urea Formula: C18H16ClN5O3S MolecularWeight: 417.86934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16ClN5O3S/c19-14-2-4-15(5-3-14)21-18(25)22-28-9-7-23(8-10-28)16-6-1-13(12-20)11-17(16)24(26)27/h1-6,11H,7-10H2,(H,21,25)