4-(azepan-1-yl)-1-thiophen-3-yl-butan-1-one

Systemtic Name: 4-(azepan-1-yl)-1-thiophen-3-yl-butan-1-one Openeye Name: 4-(azepan-1-yl)-1-(3-thienyl)butan-1-one CAS Name: 4-(1-azepanyl)-1-(3-thiophenyl)-1-butanone IUPAC Name: 4-(azepan-1-yl)-1-thiophen-3-ylbutan-1-one Traditional Name: 4-(azepan-1-yl)-1-(3-thienyl)butan-1-one Formula: C14H21NOS MolecularWeight: 251.38764

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCCC(=O)C2=CSC=C2

Isomeric SMILES

C1CCCN(CC1)CCCC(=O)C2=CSC=C2

InChI

InChI=1S/C14H21NOS/c16-14(13-7-11-17-12-13)6-5-10-15-8-3-1-2-4-9-15/h7,11-12H,1-6,8-10H2