5-methylsulfanyl-2-nitro-N-prop-2-ynyl-benzamide

Systemtic Name: 5-methylsulfanyl-2-nitro-N-prop-2-ynyl-benzamide Openeye Name: 5-methylsulfanyl-2-nitro-N-prop-2-ynyl-benzamide CAS Name: 5-(methylthio)-2-nitro-N-prop-2-ynylbenzamide IUPAC Name: 5-methylsulfanyl-2-nitro-N-prop-2-ynylbenzamide Traditional Name: 5-(methylthio)-2-nitro-N-propargyl-benzamide Formula: C11H10N2O3S MolecularWeight: 250.2737

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)NCC#C

Isomeric SMILES

CSC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)NCC#C

InChI

InChI=1S/C11H10N2O3S/c1-3-6-12-11(14)9-7-8(17-2)4-5-10(9)13(15)16/h1,4-5,7H,6H2,2H3,(H,12,14)