6-azanyl-3-(4-chlorophenyl)-4-(5-nitrothiophen-2-yl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile

Systemtic Name: 6-azanyl-3-(4-chlorophenyl)-4-(5-nitrothiophen-2-yl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: 6-amino-3-(4-chlorophenyl)-4-(5-nitro-2-thienyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: 6-amino-3-(4-chlorophenyl)-4-(5-nitro-2-thiophenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: 6-amino-3-(4-chlorophenyl)-4-(5-nitrothiophen-2-yl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: 6-amino-3-(4-chlorophenyl)-4-(5-nitro-2-thienyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Formula: C17H10ClN5O3S MolecularWeight: 399.811

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C3C(C(=C(OC3=NN2)N)C#N)C4=CC=C(S4)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1C2=C3C(C(=C(OC3=NN2)N)C#N)C4=CC=C(S4)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H10ClN5O3S/c18-9-3-1-8(2-4-9)15-14-13(11-5-6-12(27-11)23(24)25)10(7-19)16(20)26-17(14)22-21-15/h1-6,13H,20H2,(H,21,22)