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

Systemtic Name: 1-[(5-ethylpyridin-2-yl)-(5-methylthiophen-2-yl)methyl]-1,4-diazepane Openeye Name: 1-[(5-ethyl-2-pyridyl)-(5-methyl-2-thienyl)methyl]-1,4-diazepane CAS Name: 1-[(5-ethyl-2-pyridinyl)-(5-methyl-2-thiophenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(5-ethylpyridin-2-yl)-(5-methylthiophen-2-yl)methyl]-1,4-diazepane Traditional Name: 1-[(5-ethyl-2-pyridyl)-(5-methyl-2-thienyl)methyl]-1,4-diazepane Formula: C18H25N3S MolecularWeight: 315.4762

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(C=C1)C(C2=CC=C(S2)C)N3CCCNCC3

Isomeric SMILES

CCC1=CN=C(C=C1)C(C2=CC=C(S2)C)N3CCCNCC3

InChI

InChI=1S/C18H25N3S/c1-3-15-6-7-16(20-13-15)18(17-8-5-14(2)22-17)21-11-4-9-19-10-12-21/h5-8,13,18-19H,3-4,9-12H2,1-2H3