1-[(1-methylimidazol-2-yl)methyl]-4-[(3-methylthiophen-2-yl)methyl]-1,4-diazepane

Systemtic Name: 1-[(1-methylimidazol-2-yl)methyl]-4-[(3-methylthiophen-2-yl)methyl]-1,4-diazepane Openeye Name: 1-[(1-methylimidazol-2-yl)methyl]-4-[(3-methyl-2-thienyl)methyl]-1,4-diazepane CAS Name: 1-[(1-methyl-2-imidazolyl)methyl]-4-[(3-methyl-2-thiophenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(1-methylimidazol-2-yl)methyl]-4-[(3-methylthiophen-2-yl)methyl]-1,4-diazepane Traditional Name: 1-[(1-methylimidazol-2-yl)methyl]-4-[(3-methyl-2-thienyl)methyl]-1,4-diazepane Formula: C16H24N4S MolecularWeight: 304.45356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CN2CCCN(CC2)CC3=NC=CN3C

Isomeric SMILES

CC1=C(SC=C1)CN2CCCN(CC2)CC3=NC=CN3C

InChI

InChI=1S/C16H24N4S/c1-14-4-11-21-15(14)12-19-6-3-7-20(10-9-19)13-16-17-5-8-18(16)2/h4-5,8,11H,3,6-7,9-10,12-13H2,1-2H3