3-(2-nitrophenyl)sulfanyl-1-(pyridin-2-ylmethyl)indole-6-carbonitrile

Systemtic Name: 3-(2-nitrophenyl)sulfanyl-1-(pyridin-2-ylmethyl)indole-6-carbonitrile Openeye Name: 3-(2-nitrophenyl)sulfanyl-1-(2-pyridylmethyl)indole-6-carbonitrile CAS Name: 3-[(2-nitrophenyl)thio]-1-(2-pyridinylmethyl)-6-indolecarbonitrile IUPAC Name: 3-(2-nitrophenyl)sulfanyl-1-(pyridin-2-ylmethyl)indole-6-carbonitrile Traditional Name: 3-[(2-nitrophenyl)thio]-1-(2-pyridylmethyl)indole-6-carbonitrile Formula: C21H14N4O2S MolecularWeight: 386.42646

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)[N+](=O)[O-])SC2=CN(C3=C2C=CC(=C3)C#N)CC4=CC=CC=N4

Isomeric SMILES

C1=CC=C(C(=C1)[N+](=O)[O-])SC2=CN(C3=C2C=CC(=C3)C#N)CC4=CC=CC=N4

InChI

InChI=1S/C21H14N4O2S/c22-12-15-8-9-17-19(11-15)24(13-16-5-3-4-10-23-16)14-21(17)28-20-7-2-1-6-18(20)25(26)27/h1-11,14H,13H2