N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-1-(2-nitrophenyl)methanamine

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-1-(2-nitrophenyl)methanamine Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-1-(2-nitrophenyl)methanamine CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-1-(2-nitrophenyl)methanamine IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-1-(2-nitrophenyl)methanamine Traditional Name: 1,3-benzothiazol-2-ylmethyl-methyl-(2-nitrobenzyl)amine Formula: C16H15N3O2S MolecularWeight: 313.3742

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1[N+](=O)[O-])CC2=NC3=CC=CC=C3S2

Isomeric SMILES

CN(CC1=CC=CC=C1[N+](=O)[O-])CC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H15N3O2S/c1-18(10-12-6-2-4-8-14(12)19(20)21)11-16-17-13-7-3-5-9-15(13)22-16/h2-9H,10-11H2,1H3