3-methyl-N-(2-morpholin-4-yl-2-thiophen-3-yl-ethyl)-4-nitro-benzamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NCC(C2=CSC=C2)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NCC(C2=CSC=C2)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H21N3O4S/c1-13-10-14(2-3-16(13)21(23)24)18(22)19-11-17(15-4-9-26-12-15)20-5-7-25-8-6-20/h2-4,9-10,12,17H,5-8,11H2,1H3,(H,19,22)