2-[(2-fluorophenyl)carbonylamino]-6-methyl-N-(3-nitrophenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[(2-fluorophenyl)carbonylamino]-6-methyl-N-(3-nitrophenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[(2-fluorobenzoyl)amino]-6-methyl-N-(3-nitrophenyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[(2-fluorophenyl)-oxomethyl]amino]-6-methyl-N-(3-nitrophenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[(2-fluorobenzoyl)amino]-6-methyl-N-(3-nitrophenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[(2-fluorobenzoyl)amino]-6-methyl-N-(3-nitrophenyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C23H20FN3O4S MolecularWeight: 453.486003

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C(=O)NC3=CC(=CC=C3)[N+](=O)[O-])NC(=O)C4=CC=CC=C4F

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C(=O)NC3=CC(=CC=C3)[N+](=O)[O-])NC(=O)C4=CC=CC=C4F

InChI

InChI=1S/C23H20FN3O4S/c1-13-9-10-17-19(11-13)32-23(26-21(28)16-7-2-3-8-18(16)24)20(17)22(29)25-14-5-4-6-15(12-14)27(30)31/h2-8,12-13H,9-11H2,1H3,(H,25,29)(H,26,28)