5-(5-chloranyl-3-methyl-1-benzothiophen-2-yl)-1-(4-nitrophenyl)pyrazole-4-carbonitrile

Systemtic Name: 5-(5-chloranyl-3-methyl-1-benzothiophen-2-yl)-1-(4-nitrophenyl)pyrazole-4-carbonitrile Openeye Name: 5-(5-chloro-3-methyl-benzothiophen-2-yl)-1-(4-nitrophenyl)pyrazole-4-carbonitrile CAS Name: 5-(5-chloro-3-methyl-1-benzothiophen-2-yl)-1-(4-nitrophenyl)-4-pyrazolecarbonitrile IUPAC Name: 5-(5-chloro-3-methyl-1-benzothiophen-2-yl)-1-(4-nitrophenyl)pyrazole-4-carbonitrile Traditional Name: 5-(5-chloro-3-methyl-benzothiophen-2-yl)-1-(4-nitrophenyl)pyrazole-4-carbonitrile Formula: C19H11ClN4O2S MolecularWeight: 394.83424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C=C(C=C2)Cl)C3=C(C=NN3C4=CC=C(C=C4)[N+](=O)[O-])C#N

Isomeric SMILES

CC1=C(SC2=C1C=C(C=C2)Cl)C3=C(C=NN3C4=CC=C(C=C4)[N+](=O)[O-])C#N

InChI

InChI=1S/C19H11ClN4O2S/c1-11-16-8-13(20)2-7-17(16)27-19(11)18-12(9-21)10-22-23(18)14-3-5-15(6-4-14)24(25)26/h2-8,10H,1H3