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azepan-1-yl-[5-[(5-chloranylthiophen-2-yl)methylamino]-1-ethyl-4,5,6,7-tetrahydroindazol-3-yl]methanone

azepan-1-yl-[5-[(5-chloranylthiophen-2-yl)methylamino]-1-ethyl-4,5,6,7-tetrahydroindazol-3-yl]methanone

Systemtic Name:azepan-1-yl-[5-[(5-chloranylthiophen-2-yl)methylamino]-1-ethyl-4,5,6,7-tetrahydroindazol-3-yl]methanone
Openeye Name:azepan-1-yl-[5-[(5-chloro-2-thienyl)methylamino]-1-ethyl-4,5,6,7-tetrahydroindazol-3-yl]methanone
CAS Name:1-azepanyl-[5-[(5-chloro-2-thiophenyl)methylamino]-1-ethyl-4,5,6,7-tetrahydroindazol-3-yl]methanone
IUPAC Name:azepan-1-yl-[5-[(5-chlorothiophen-2-yl)methylamino]-1-ethyl-4,5,6,7-tetrahydroindazol-3-yl]methanone
Traditional Name:azepan-1-yl-[5-[(5-chloro-2-thienyl)methylamino]-1-ethyl-4,5,6,7-tetrahydroindazol-3-yl]methanone
Formula: C21H29ClN4OS
MolecularWeight: 420.99916
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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(CC(CC2)NCC3=CC=C(S3)Cl)C(=N1)C(=O)N4CCCCCC4


Isomeric SMILES

CCN1C2=C(CC(CC2)NCC3=CC=C(S3)Cl)C(=N1)C(=O)N4CCCCCC4


InChI

InChI=1S/C21H29ClN4OS/c1-2-26-18-9-7-15(23-14-16-8-10-19(22)28-16)13-17(18)20(24-26)21(27)25-11-5-3-4-6-12-25/h8,10,15,23H,2-7,9,11-14H2,1H3


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