4-[ethyl-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]amino]-3-nitro-benzamide

Systemtic Name: 4-[ethyl-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]amino]-3-nitro-benzamide Openeye Name: 4-[ethyl-[2-oxo-2-(2-thienylmethylamino)ethyl]amino]-3-nitro-benzamide CAS Name: 4-[ethyl-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]amino]-3-nitrobenzamide IUPAC Name: 4-[ethyl-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]amino]-3-nitrobenzamide Traditional Name: 4-[ethyl-[2-keto-2-(2-thenylamino)ethyl]amino]-3-nitro-benzamide Formula: C16H18N4O4S MolecularWeight: 362.40352

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NCC1=CC=CS1)C2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CCN(CC(=O)NCC1=CC=CS1)C2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C16H18N4O4S/c1-2-19(10-15(21)18-9-12-4-3-7-25-12)13-6-5-11(16(17)22)8-14(13)20(23)24/h3-8H,2,9-10H2,1H3,(H2,17,22)(H,18,21)