1-[(5-methylthiophen-2-yl)-pyridin-2-yl-methyl]-1,4-diazepane

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(C2=CC=CC=N2)N3CCCNCC3

Isomeric SMILES

CC1=CC=C(S1)C(C2=CC=CC=N2)N3CCCNCC3

InChI

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