1-[4-[3-[4-(3-chloranylthiophen-2-yl)carbonylpiperazin-1-yl]propoxy]phenyl]hexan-1-one

Systemtic Name: 1-[4-[3-[4-(3-chloranylthiophen-2-yl)carbonylpiperazin-1-yl]propoxy]phenyl]hexan-1-one Openeye Name: 1-[4-[3-[4-(3-chlorothiophene-2-carbonyl)piperazin-1-yl]propoxy]phenyl]hexan-1-one CAS Name: 1-[4-[3-[4-[(3-chloro-2-thiophenyl)-oxomethyl]-1-piperazinyl]propoxy]phenyl]-1-hexanone IUPAC Name: 1-[4-[3-[4-(3-chlorothiophene-2-carbonyl)piperazin-1-yl]propoxy]phenyl]hexan-1-one Traditional Name: 1-[4-[3-[4-(3-chlorothiophene-2-carbonyl)piperazino]propoxy]phenyl]hexan-1-one Formula: C24H31ClN2O3S MolecularWeight: 463.03254

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C1=CC=C(C=C1)OCCCN2CCN(CC2)C(=O)C3=C(C=CS3)Cl

Isomeric SMILES

CCCCCC(=O)C1=CC=C(C=C1)OCCCN2CCN(CC2)C(=O)C3=C(C=CS3)Cl

InChI

InChI=1S/C24H31ClN2O3S/c1-2-3-4-6-22(28)19-7-9-20(10-8-19)30-17-5-12-26-13-15-27(16-14-26)24(29)23-21(25)11-18-31-23/h7-11,18H,2-6,12-17H2,1H3