3-[2-cyanoethyl-[5-(2-nitrophenyl)sulfanyl-1,3-thiazol-2-yl]amino]propanenitrile

Systemtic Name: 3-[2-cyanoethyl-[5-(2-nitrophenyl)sulfanyl-1,3-thiazol-2-yl]amino]propanenitrile Openeye Name: 3-[2-cyanoethyl-[5-(2-nitrophenyl)sulfanylthiazol-2-yl]amino]propanenitrile CAS Name: 3-[2-cyanoethyl-[5-[(2-nitrophenyl)thio]-2-thiazolyl]amino]propanenitrile IUPAC Name: 3-[2-cyanoethyl-[5-(2-nitrophenyl)sulfanyl-1,3-thiazol-2-yl]amino]propanenitrile Traditional Name: 3-[2-cyanoethyl-[5-[(2-nitrophenyl)thio]thiazol-2-yl]amino]propionitrile Formula: C15H13N5O2S2 MolecularWeight: 359.42602

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)[N+](=O)[O-])SC2=CN=C(S2)N(CCC#N)CCC#N

Isomeric SMILES

C1=CC=C(C(=C1)[N+](=O)[O-])SC2=CN=C(S2)N(CCC#N)CCC#N

InChI

InChI=1S/C15H13N5O2S2/c16-7-3-9-19(10-4-8-17)15-18-11-14(24-15)23-13-6-2-1-5-12(13)20(21)22/h1-2,5-6,11H,3-4,9-10H2