N-(1,3-benzothiazol-2-ylmethyl)-1-(5-nitrofuran-2-yl)methanamine

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(5-nitrofuran-2-yl)methanamine Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(5-nitro-2-furyl)methanamine CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(5-nitro-2-furanyl)methanamine IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(5-nitrofuran-2-yl)methanamine Traditional Name: 1,3-benzothiazol-2-ylmethyl-[(5-nitro-2-furyl)methyl]amine Formula: C13H11N3O3S MolecularWeight: 289.30974

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CNCC3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CNCC3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C13H11N3O3S/c17-16(18)13-6-5-9(19-13)7-14-8-12-15-10-3-1-2-4-11(10)20-12/h1-6,14H,7-8H2