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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)NN=C(C)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1CCC2=C(C1)C=C(S2)C(=O)N/N=C(\C)/C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O3S/c1-11-3-8-16-14(9-11)10-17(25-16)18(22)20-19-12(2)13-4-6-15(7-5-13)21(23)24/h4-7,10-11H,3,8-9H2,1-2H3,(H,20,22)/b19-12+