N-(3,4-dihydro-2H-thiochromen-4-yl)-1-methyl-4-nitro-pyrrole-2-carboxamide

Systemtic Name: N-(3,4-dihydro-2H-thiochromen-4-yl)-1-methyl-4-nitro-pyrrole-2-carboxamide Openeye Name: 1-methyl-4-nitro-N-thiochroman-4-yl-pyrrole-2-carboxamide CAS Name: N-(3,4-dihydro-2H-1-benzothiopyran-4-yl)-1-methyl-4-nitro-2-pyrrolecarboxamide IUPAC Name: N-(3,4-dihydro-2H-thiochromen-4-yl)-1-methyl-4-nitropyrrole-2-carboxamide Traditional Name: 1-methyl-4-nitro-N-thiochroman-4-yl-pyrrole-2-carboxamide Formula: C15H15N3O3S MolecularWeight: 317.3629

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NC2CCSC3=CC=CC=C23)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=C1C(=O)NC2CCSC3=CC=CC=C23)[N+](=O)[O-]

InChI

InChI=1S/C15H15N3O3S/c1-17-9-10(18(20)21)8-13(17)15(19)16-12-6-7-22-14-5-3-2-4-11(12)14/h2-5,8-9,12H,6-7H2,1H3,(H,16,19)