2-[1,4-diazepan-1-yl(naphthalen-1-yl)methyl]-1,3-benzothiazole

Systemtic Name: 2-[1,4-diazepan-1-yl(naphthalen-1-yl)methyl]-1,3-benzothiazole Openeye Name: 2-[1,4-diazepan-1-yl(1-naphthyl)methyl]-1,3-benzothiazole CAS Name: 2-[1,4-diazepan-1-yl(1-naphthalenyl)methyl]-1,3-benzothiazole IUPAC Name: 2-[1,4-diazepan-1-yl(naphthalen-1-yl)methyl]-1,3-benzothiazole Traditional Name: 2-[1,4-diazepan-1-yl(1-naphthyl)methyl]-1,3-benzothiazole Formula: C23H23N3S MolecularWeight: 373.51382

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(C2=CC=CC3=CC=CC=C32)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CNCCN(C1)C(C2=CC=CC3=CC=CC=C32)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C23H23N3S/c1-2-9-18-17(7-1)8-5-10-19(18)22(26-15-6-13-24-14-16-26)23-25-20-11-3-4-12-21(20)27-23/h1-5,7-12,22,24H,6,13-16H2