2-[4-(diethylamino)phenyl]sulfanyl-6-nitro-benzenecarbonitrile

Systemtic Name: 2-[4-(diethylamino)phenyl]sulfanyl-6-nitro-benzenecarbonitrile Openeye Name: 2-[4-(diethylamino)phenyl]sulfanyl-6-nitro-benzonitrile CAS Name: 2-[[4-(diethylamino)phenyl]thio]-6-nitrobenzonitrile IUPAC Name: 2-[4-(diethylamino)phenyl]sulfanyl-6-nitrobenzonitrile Traditional Name: 2-[[4-(diethylamino)phenyl]thio]-6-nitro-benzonitrile Formula: C17H17N3O2S MolecularWeight: 327.40078

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)SC2=CC=CC(=C2C#N)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)SC2=CC=CC(=C2C#N)[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O2S/c1-3-19(4-2)13-8-10-14(11-9-13)23-17-7-5-6-16(20(21)22)15(17)12-18/h5-11H,3-4H2,1-2H3