N-(1,3-benzothiazol-2-ylmethyl)-1-pyridin-4-yl-methanamine

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-1-pyridin-4-yl-methanamine Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(4-pyridyl)methanamine CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-1-pyridin-4-ylmethanamine IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-1-pyridin-4-ylmethanamine Traditional Name: 1,3-benzothiazol-2-ylmethyl(4-pyridylmethyl)amine Formula: C14H13N3S MolecularWeight: 255.33812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CNCC3=CC=NC=C3

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CNCC3=CC=NC=C3

InChI

InChI=1S/C14H13N3S/c1-2-4-13-12(3-1)17-14(18-13)10-16-9-11-5-7-15-8-6-11/h1-8,16H,9-10H2