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

Systemtic Name: 2-[4-(phenylmethyl)-1,4-diazepan-1-yl]-1,3-benzothiazole Openeye Name: 2-(4-benzyl-1,4-diazepan-1-yl)-1,3-benzothiazole CAS Name: 2-[4-(phenylmethyl)-1,4-diazepan-1-yl]-1,3-benzothiazole IUPAC Name: 2-(4-benzyl-1,4-diazepan-1-yl)-1,3-benzothiazole Traditional Name: 2-(4-benzyl-1,4-diazepan-1-yl)-1,3-benzothiazole Formula: C19H21N3S MolecularWeight: 323.45514

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C2=NC3=CC=CC=C3S2)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN(C1)C2=NC3=CC=CC=C3S2)CC4=CC=CC=C4

InChI

InChI=1S/C19H21N3S/c1-2-7-16(8-3-1)15-21-11-6-12-22(14-13-21)19-20-17-9-4-5-10-18(17)23-19/h1-5,7-10H,6,11-15H2