N-[2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]-N-ethyl-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]-N-ethyl-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[2-[(4-chlorophenyl)methylamino]-2-oxo-ethyl]-N-ethyl-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]-N-ethyl-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]-N-ethyl-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[2-[(4-chlorobenzyl)amino]-2-keto-ethyl]-N-ethyl-5-nitro-benzothiophene-2-carboxamide Formula: C20H18ClN3O4S MolecularWeight: 431.89262

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NCC1=CC=C(C=C1)Cl)C(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CCN(CC(=O)NCC1=CC=C(C=C1)Cl)C(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H18ClN3O4S/c1-2-23(12-19(25)22-11-13-3-5-15(21)6-4-13)20(26)18-10-14-9-16(24(27)28)7-8-17(14)29-18/h3-10H,2,11-12H2,1H3,(H,22,25)