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

Systemtic Name: 2-[1,4-diazepan-1-yl-(3-methylpyridin-4-yl)methyl]-1,3-benzothiazole Openeye Name: 2-[1,4-diazepan-1-yl-(3-methyl-4-pyridyl)methyl]-1,3-benzothiazole CAS Name: 2-[1,4-diazepan-1-yl-(3-methyl-4-pyridinyl)methyl]-1,3-benzothiazole IUPAC Name: 2-[1,4-diazepan-1-yl-(3-methylpyridin-4-yl)methyl]-1,3-benzothiazole Traditional Name: 2-[1,4-diazepan-1-yl-(3-methyl-4-pyridyl)methyl]-1,3-benzothiazole Formula: C19H22N4S MolecularWeight: 338.46978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1)C(C2=NC3=CC=CC=C3S2)N4CCCNCC4

Isomeric SMILES

CC1=C(C=CN=C1)C(C2=NC3=CC=CC=C3S2)N4CCCNCC4

InChI

InChI=1S/C19H22N4S/c1-14-13-21-9-7-15(14)18(23-11-4-8-20-10-12-23)19-22-16-5-2-3-6-17(16)24-19/h2-3,5-7,9,13,18,20H,4,8,10-12H2,1H3