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

Systemtic Name: 4-methyl-2-[(2-nitrophenyl)carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 4-methyl-2-[(2-nitrobenzoyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 4-methyl-2-[[(2-nitrophenyl)-oxomethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 4-methyl-2-[(2-nitrobenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 4-methyl-2-[(2-nitrobenzoyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C17H17N3O4S MolecularWeight: 359.39958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC2=C1C(=C(S2)NC(=O)C3=CC=CC=C3[N+](=O)[O-])C(=O)N

Isomeric SMILES

CC1CCCC2=C1C(=C(S2)NC(=O)C3=CC=CC=C3[N+](=O)[O-])C(=O)N

InChI

InChI=1S/C17H17N3O4S/c1-9-5-4-8-12-13(9)14(15(18)21)17(25-12)19-16(22)10-6-2-3-7-11(10)20(23)24/h2-3,6-7,9H,4-5,8H2,1H3,(H2,18,21)(H,19,22)