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

Systemtic Name: 2-[1,4-diazepan-1-yl-(3-methylthiophen-2-yl)methyl]-1,3-benzothiazole Openeye Name: 2-[1,4-diazepan-1-yl-(3-methyl-2-thienyl)methyl]-1,3-benzothiazole CAS Name: 2-[1,4-diazepan-1-yl-(3-methyl-2-thiophenyl)methyl]-1,3-benzothiazole IUPAC Name: 2-[1,4-diazepan-1-yl-(3-methylthiophen-2-yl)methyl]-1,3-benzothiazole Traditional Name: 2-[1,4-diazepan-1-yl-(3-methyl-2-thienyl)methyl]-1,3-benzothiazole Formula: C18H21N3S2 MolecularWeight: 343.50944

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3S2/c1-13-7-12-22-17(13)16(21-10-4-8-19-9-11-21)18-20-14-5-2-3-6-15(14)23-18/h2-3,5-7,12,16,19H,4,8-11H2,1H3