N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-4-(methylamino)-3-nitro-benzamide

Systemtic Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-4-(methylamino)-3-nitro-benzamide Openeye Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-4-(methylamino)-3-nitro-benzamide CAS Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-4-(methylamino)-3-nitrobenzamide IUPAC Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-4-(methylamino)-3-nitrobenzamide Traditional Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-4-(methylamino)-3-nitro-benzamide Formula: C18H18N4O3S MolecularWeight: 370.42552

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2S1)N(C)C(=O)C3=CC(=C(C=C3)NC)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C1=NC2=CC=CC=C2S1)N(C)C(=O)C3=CC(=C(C=C3)NC)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O3S/c1-11(17-20-14-6-4-5-7-16(14)26-17)21(3)18(23)12-8-9-13(19-2)15(10-12)22(24)25/h4-11,19H,1-3H3/t11-/m1/s1