N-[3-[[(1R)-2-methyl-1-thiophen-2-yl-propyl]amino]-3-oxidanylidene-propyl]-4-nitro-benzamide

Systemtic Name: N-[3-[[(1R)-2-methyl-1-thiophen-2-yl-propyl]amino]-3-oxidanylidene-propyl]-4-nitro-benzamide Openeye Name: N-[3-[[(1R)-2-methyl-1-(2-thienyl)propyl]amino]-3-oxo-propyl]-4-nitro-benzamide CAS Name: N-[3-[[(1R)-2-methyl-1-thiophen-2-ylpropyl]amino]-3-oxopropyl]-4-nitrobenzamide IUPAC Name: N-[3-[[(1R)-2-methyl-1-thiophen-2-ylpropyl]amino]-3-oxopropyl]-4-nitrobenzamide Traditional Name: N-[3-keto-3-[[(1R)-2-methyl-1-(2-thienyl)propyl]amino]propyl]-4-nitro-benzamide Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=CS1)NC(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)[C@H](C1=CC=CS1)NC(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H21N3O4S/c1-12(2)17(15-4-3-11-26-15)20-16(22)9-10-19-18(23)13-5-7-14(8-6-13)21(24)25/h3-8,11-12,17H,9-10H2,1-2H3,(H,19,23)(H,20,22)/t17-/m1/s1