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

Systemtic Name: N-[(E)-1-(4-methyl-3-nitro-phenyl)ethylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: N-[(E)-1-(4-methyl-3-nitro-phenyl)ethylideneamino]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: N-[(E)-1-(4-methyl-3-nitrophenyl)ethylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: N-[(E)-1-(4-methyl-3-nitrophenyl)ethylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: N-[(E)-1-(4-methyl-3-nitro-phenyl)ethylideneamino]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C18H19N3O3S MolecularWeight: 357.42676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=NNC(=O)C2=CC3=C(S2)CCCC3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)/C(=N/NC(=O)C2=CC3=C(S2)CCCC3)/C)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O3S/c1-11-7-8-13(9-15(11)21(23)24)12(2)19-20-18(22)17-10-14-5-3-4-6-16(14)25-17/h7-10H,3-6H2,1-2H3,(H,20,22)/b19-12+