1-[(6-methylpyridin-2-yl)methyl]-4-[(3-methylthiophen-2-yl)methyl]-1,4-diazepane

Systemtic Name: 1-[(6-methylpyridin-2-yl)methyl]-4-[(3-methylthiophen-2-yl)methyl]-1,4-diazepane Openeye Name: 1-[(6-methyl-2-pyridyl)methyl]-4-[(3-methyl-2-thienyl)methyl]-1,4-diazepane CAS Name: 1-[(6-methyl-2-pyridinyl)methyl]-4-[(3-methyl-2-thiophenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(6-methylpyridin-2-yl)methyl]-4-[(3-methylthiophen-2-yl)methyl]-1,4-diazepane Traditional Name: 1-[(6-methyl-2-pyridyl)methyl]-4-[(3-methyl-2-thienyl)methyl]-1,4-diazepane Formula: C18H25N3S MolecularWeight: 315.4762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CN2CCCN(CC2)CC3=CC=CC(=N3)C

Isomeric SMILES

CC1=C(SC=C1)CN2CCCN(CC2)CC3=CC=CC(=N3)C

InChI

InChI=1S/C18H25N3S/c1-15-7-12-22-18(15)14-21-9-4-8-20(10-11-21)13-17-6-3-5-16(2)19-17/h3,5-7,12H,4,8-11,13-14H2,1-2H3