2-[[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-methyl-amino]-N-(2-methyl-5-nitro-phenyl)ethanamide

Systemtic Name: 2-[[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-methyl-amino]-N-(2-methyl-5-nitro-phenyl)ethanamide Openeye Name: 2-[[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-methyl-amino]-N-(2-methyl-5-nitro-phenyl)acetamide CAS Name: 2-[[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-methylamino]-N-(2-methyl-5-nitrophenyl)acetamide IUPAC Name: 2-[[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-methylamino]-N-(2-methyl-5-nitrophenyl)acetamide Traditional Name: 2-[[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-methyl-amino]-N-(2-methyl-5-nitro-phenyl)acetamide Formula: C19H20N4O3S MolecularWeight: 384.4521

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CN(C)C(C)C2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CN(C)[C@H](C)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H20N4O3S/c1-12-8-9-14(23(25)26)10-16(12)20-18(24)11-22(3)13(2)19-21-15-6-4-5-7-17(15)27-19/h4-10,13H,11H2,1-3H3,(H,20,24)/t13-/m1/s1