7-(2-methoxyethoxy)-4-(5-nitrothiophen-2-yl)sulfanyl-quinoline-6-carbonitrile

Systemtic Name: 7-(2-methoxyethoxy)-4-(5-nitrothiophen-2-yl)sulfanyl-quinoline-6-carbonitrile Openeye Name: 7-(2-methoxyethoxy)-4-[(5-nitro-2-thienyl)sulfanyl]quinoline-6-carbonitrile CAS Name: 7-(2-methoxyethoxy)-4-[(5-nitro-2-thiophenyl)thio]-6-quinolinecarbonitrile IUPAC Name: 7-(2-methoxyethoxy)-4-(5-nitrothiophen-2-yl)sulfanylquinoline-6-carbonitrile Traditional Name: 7-(2-methoxyethoxy)-4-[(5-nitro-2-thienyl)thio]quinoline-6-carbonitrile Formula: C17H13N3O4S2 MolecularWeight: 387.43282

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=CC2=NC=CC(=C2C=C1C#N)SC3=CC=C(S3)[N+](=O)[O-]

Isomeric SMILES

COCCOC1=CC2=NC=CC(=C2C=C1C#N)SC3=CC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C17H13N3O4S2/c1-23-6-7-24-14-9-13-12(8-11(14)10-18)15(4-5-19-13)25-17-3-2-16(26-17)20(21)22/h2-5,8-9H,6-7H2,1H3