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

Systemtic Name: 2-[1,4-diazepan-1-yl-(2-methylphenyl)methyl]-1,3-benzothiazole Openeye Name: 2-[1,4-diazepan-1-yl(o-tolyl)methyl]-1,3-benzothiazole CAS Name: 2-[1,4-diazepan-1-yl-(2-methylphenyl)methyl]-1,3-benzothiazole IUPAC Name: 2-[1,4-diazepan-1-yl-(2-methylphenyl)methyl]-1,3-benzothiazole Traditional Name: 2-[1,4-diazepan-1-yl(o-tolyl)methyl]-1,3-benzothiazole Formula: C20H23N3S MolecularWeight: 337.48172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C2=NC3=CC=CC=C3S2)N4CCCNCC4

Isomeric SMILES

CC1=CC=CC=C1C(C2=NC3=CC=CC=C3S2)N4CCCNCC4

InChI

InChI=1S/C20H23N3S/c1-15-7-2-3-8-16(15)19(23-13-6-11-21-12-14-23)20-22-17-9-4-5-10-18(17)24-20/h2-5,7-10,19,21H,6,11-14H2,1H3