4-nitro-N-[3-oxidanylidene-3-[prop-2-enyl(thiophen-2-ylmethyl)amino]propyl]benzamide

Systemtic Name: 4-nitro-N-[3-oxidanylidene-3-[prop-2-enyl(thiophen-2-ylmethyl)amino]propyl]benzamide Openeye Name: N-[3-[allyl(2-thienylmethyl)amino]-3-oxo-propyl]-4-nitro-benzamide CAS Name: 4-nitro-N-[3-oxo-3-[prop-2-enyl(thiophen-2-ylmethyl)amino]propyl]benzamide IUPAC Name: 4-nitro-N-[3-oxo-3-[prop-2-enyl(thiophen-2-ylmethyl)amino]propyl]benzamide Traditional Name: N-[3-[allyl(2-thenyl)amino]-3-keto-propyl]-4-nitro-benzamide Formula: C18H19N3O4S MolecularWeight: 373.42616

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC1=CC=CS1)C(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C=CCN(CC1=CC=CS1)C(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O4S/c1-2-11-20(13-16-4-3-12-26-16)17(22)9-10-19-18(23)14-5-7-15(8-6-14)21(24)25/h2-8,12H,1,9-11,13H2,(H,19,23)