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4-[(5-methylthiophen-2-yl)-(1H-1,2,4-triazol-5-yl)methyl]azepane

4-[(5-methylthiophen-2-yl)-(1H-1,2,4-triazol-5-yl)methyl]azepane

Systemtic Name:4-[(5-methylthiophen-2-yl)-(1H-1,2,4-triazol-5-yl)methyl]azepane
Openeye Name:4-[(5-methyl-2-thienyl)-(1H-1,2,4-triazol-5-yl)methyl]azepane
CAS Name:4-[(5-methyl-2-thiophenyl)-(1H-1,2,4-triazol-5-yl)methyl]azepane
IUPAC Name:4-[(5-methylthiophen-2-yl)-(1H-1,2,4-triazol-5-yl)methyl]azepane
Traditional Name:4-[(5-methyl-2-thienyl)-(1H-1,2,4-triazol-5-yl)methyl]azepane
Formula: C14H20N4S
MolecularWeight: 276.4004
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(C2CCCNCC2)C3=NC=NN3


Isomeric SMILES

CC1=CC=C(S1)C(C2CCCNCC2)C3=NC=NN3


InChI

InChI=1S/C14H20N4S/c1-10-4-5-12(19-10)13(14-16-9-17-18-14)11-3-2-7-15-8-6-11/h4-5,9,11,13,15H,2-3,6-8H2,1H3,(H,16,17,18)


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