2-methyl-N-[(3-nitrophenyl)methyl]-1,3-benzothiazol-6-amine

Systemtic Name: 2-methyl-N-[(3-nitrophenyl)methyl]-1,3-benzothiazol-6-amine Openeye Name: 2-methyl-N-[(3-nitrophenyl)methyl]-1,3-benzothiazol-6-amine CAS Name: 2-methyl-N-[(3-nitrophenyl)methyl]-1,3-benzothiazol-6-amine IUPAC Name: 2-methyl-N-[(3-nitrophenyl)methyl]-1,3-benzothiazol-6-amine Traditional Name: (2-methyl-1,3-benzothiazol-6-yl)-(3-nitrobenzyl)amine Formula: C15H13N3O2S MolecularWeight: 299.34762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)NCC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)NCC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H13N3O2S/c1-10-17-14-6-5-12(8-15(14)21-10)16-9-11-3-2-4-13(7-11)18(19)20/h2-8,16H,9H2,1H3