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

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-N-(1,3-benzothiazol-2-ylmethyl)methanamine Openeye Name: 1-(1,3-benzothiazol-2-yl)-N-(1,3-benzothiazol-2-ylmethyl)methanamine CAS Name: 1-(1,3-benzothiazol-2-yl)-N-(1,3-benzothiazol-2-ylmethyl)methanamine IUPAC Name: 1-(1,3-benzothiazol-2-yl)-N-(1,3-benzothiazol-2-ylmethyl)methanamine Traditional Name: bis(1,3-benzothiazol-2-ylmethyl)amine Formula: C16H13N3S2 MolecularWeight: 311.42452

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CNCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CNCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C16H13N3S2/c1-3-7-13-11(5-1)18-15(20-13)9-17-10-16-19-12-6-2-4-8-14(12)21-16/h1-8,17H,9-10H2