1-[(6-methylpyridin-2-yl)-(4-methylthiophen-2-yl)methyl]-1,4-diazepane

Systemtic Name: 1-[(6-methylpyridin-2-yl)-(4-methylthiophen-2-yl)methyl]-1,4-diazepane Openeye Name: 1-[(6-methyl-2-pyridyl)-(4-methyl-2-thienyl)methyl]-1,4-diazepane CAS Name: 1-[(6-methyl-2-pyridinyl)-(4-methyl-2-thiophenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(6-methylpyridin-2-yl)-(4-methylthiophen-2-yl)methyl]-1,4-diazepane Traditional Name: 1-[(6-methyl-2-pyridyl)-(4-methyl-2-thienyl)methyl]-1,4-diazepane Formula: C17H23N3S MolecularWeight: 301.44962

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23N3S/c1-13-11-16(21-12-13)17(15-6-3-5-14(2)19-15)20-9-4-7-18-8-10-20/h3,5-6,11-12,17-18H,4,7-10H2,1-2H3