6-methyl-N-(4-methyl-2-nitro-phenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 6-methyl-N-(4-methyl-2-nitro-phenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 6-methyl-N-(4-methyl-2-nitro-phenyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 6-methyl-N-(4-methyl-2-nitrophenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 6-methyl-N-(4-methyl-2-nitrophenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 6-methyl-N-(4-methyl-2-nitro-phenyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC=C2C(=O)NC3=C(C=C(C=C3)C)[N+](=O)[O-]

Isomeric SMILES

CC1CCC2=C(C1)SC=C2C(=O)NC3=C(C=C(C=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C17H18N2O3S/c1-10-4-6-14(15(7-10)19(21)22)18-17(20)13-9-23-16-8-11(2)3-5-12(13)16/h4,6-7,9,11H,3,5,8H2,1-2H3,(H,18,20)