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

Systemtic Name: 1-[(3-methylpyridin-4-yl)-thiophen-2-yl-methyl]-1,4-diazepane Openeye Name: 1-[(3-methyl-4-pyridyl)-(2-thienyl)methyl]-1,4-diazepane CAS Name: 1-[(3-methyl-4-pyridinyl)-thiophen-2-ylmethyl]-1,4-diazepane IUPAC Name: 1-[(3-methylpyridin-4-yl)-thiophen-2-ylmethyl]-1,4-diazepane Traditional Name: 1-[(3-methyl-4-pyridyl)-(2-thienyl)methyl]-1,4-diazepane Formula: C16H21N3S MolecularWeight: 287.42304

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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