1-[(5-methylpyridin-2-yl)-thiophen-2-yl-methyl]-1,4-diazepane

Systemtic Name: 1-[(5-methylpyridin-2-yl)-thiophen-2-yl-methyl]-1,4-diazepane Openeye Name: 1-[(5-methyl-2-pyridyl)-(2-thienyl)methyl]-1,4-diazepane CAS Name: 1-[(5-methyl-2-pyridinyl)-thiophen-2-ylmethyl]-1,4-diazepane IUPAC Name: 1-[(5-methylpyridin-2-yl)-thiophen-2-ylmethyl]-1,4-diazepane Traditional Name: 1-[(5-methyl-2-pyridyl)-(2-thienyl)methyl]-1,4-diazepane Formula: C16H21N3S MolecularWeight: 287.42304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)C(C2=CC=CS2)N3CCCNCC3

Isomeric SMILES

CC1=CN=C(C=C1)C(C2=CC=CS2)N3CCCNCC3

InChI

InChI=1S/C16H21N3S/c1-13-5-6-14(18-12-13)16(15-4-2-11-20-15)19-9-3-7-17-8-10-19/h2,4-6,11-12,16-17H,3,7-10H2,1H3