5-nitro-N-(phenylmethyl)-N-propyl-1-benzothiophene-2-carboxamide

Systemtic Name: 5-nitro-N-(phenylmethyl)-N-propyl-1-benzothiophene-2-carboxamide Openeye Name: N-benzyl-5-nitro-N-propyl-benzothiophene-2-carboxamide CAS Name: 5-nitro-N-(phenylmethyl)-N-propyl-1-benzothiophene-2-carboxamide IUPAC Name: N-benzyl-5-nitro-N-propyl-1-benzothiophene-2-carboxamide Traditional Name: N-benzyl-5-nitro-N-propyl-benzothiophene-2-carboxamide Formula: C19H18N2O3S MolecularWeight: 354.42282

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=CC=C1)C(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CCCN(CC1=CC=CC=C1)C(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H18N2O3S/c1-2-10-20(13-14-6-4-3-5-7-14)19(22)18-12-15-11-16(21(23)24)8-9-17(15)25-18/h3-9,11-12H,2,10,13H2,1H3