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

Systemtic Name: 1-[(3-methylpyridin-4-yl)-thiophen-3-yl-methyl]-1,4-diazepane Openeye Name: 1-[(3-methyl-4-pyridyl)-(3-thienyl)methyl]-1,4-diazepane CAS Name: 1-[(3-methyl-4-pyridinyl)-(3-thiophenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(3-methylpyridin-4-yl)-thiophen-3-ylmethyl]-1,4-diazepane Traditional Name: 1-[(3-methyl-4-pyridyl)-(3-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=CSC=C2)N3CCCNCC3

Isomeric SMILES

CC1=C(C=CN=C1)C(C2=CSC=C2)N3CCCNCC3

InChI

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