N-methyl-N-[(3-methylthiophen-2-yl)methyl]-4-morpholin-4-yl-3-nitro-benzamide

Systemtic Name: N-methyl-N-[(3-methylthiophen-2-yl)methyl]-4-morpholin-4-yl-3-nitro-benzamide Openeye Name: N-methyl-N-[(3-methyl-2-thienyl)methyl]-4-morpholino-3-nitro-benzamide CAS Name: N-methyl-N-[(3-methyl-2-thiophenyl)methyl]-4-(4-morpholinyl)-3-nitrobenzamide IUPAC Name: N-methyl-N-[(3-methylthiophen-2-yl)methyl]-4-morpholin-4-yl-3-nitrobenzamide Traditional Name: N-methyl-N-[(3-methyl-2-thienyl)methyl]-4-morpholino-3-nitro-benzamide Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CN(C)C(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(SC=C1)CN(C)C(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H21N3O4S/c1-13-5-10-26-17(13)12-19(2)18(22)14-3-4-15(16(11-14)21(23)24)20-6-8-25-9-7-20/h3-5,10-11H,6-9,12H2,1-2H3