2-[2-[2-(3-chlorophenyl)-1,3-thiazol-4-yl]ethylamino]-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[2-[2-(3-chlorophenyl)-1,3-thiazol-4-yl]ethylamino]-5-nitro-benzenecarbonitrile Openeye Name: 2-[2-[2-(3-chlorophenyl)thiazol-4-yl]ethylamino]-5-nitro-benzonitrile CAS Name: 2-[2-[2-(3-chlorophenyl)-4-thiazolyl]ethylamino]-5-nitrobenzonitrile IUPAC Name: 2-[2-[2-(3-chlorophenyl)-1,3-thiazol-4-yl]ethylamino]-5-nitrobenzonitrile Traditional Name: 2-[2-[2-(3-chlorophenyl)thiazol-4-yl]ethylamino]-5-nitro-benzonitrile Formula: C18H13ClN4O2S MolecularWeight: 384.83942

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C2=NC(=CS2)CCNC3=C(C=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C2=NC(=CS2)CCNC3=C(C=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C18H13ClN4O2S/c19-14-3-1-2-12(8-14)18-22-15(11-26-18)6-7-21-17-5-4-16(23(24)25)9-13(17)10-20/h1-5,8-9,11,21H,6-7H2