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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=C1)C(C2=CC=NC=C2)N3CCCNCC3

Isomeric SMILES

CC1=CSC(=C1)C(C2=CC=NC=C2)N3CCCNCC3

InChI

InChI=1S/C16H21N3S/c1-13-11-15(20-12-13)16(14-3-6-18-7-4-14)19-9-2-5-17-8-10-19/h3-4,6-7,11-12,16-17H,2,5,8-10H2,1H3