N-[4-[4-[2-(2-chloranylphenoxy)ethyl]piperazin-1-yl]-4-oxidanylidene-butyl]thiophene-3-carboxamide

Systemtic Name: N-[4-[4-[2-(2-chloranylphenoxy)ethyl]piperazin-1-yl]-4-oxidanylidene-butyl]thiophene-3-carboxamide Openeye Name: N-[4-[4-[2-(2-chlorophenoxy)ethyl]piperazin-1-yl]-4-oxo-butyl]thiophene-3-carboxamide CAS Name: N-[4-[4-[2-(2-chlorophenoxy)ethyl]-1-piperazinyl]-4-oxobutyl]-3-thiophenecarboxamide IUPAC Name: N-[4-[4-[2-(2-chlorophenoxy)ethyl]piperazin-1-yl]-4-oxobutyl]thiophene-3-carboxamide Traditional Name: N-[4-[4-[2-(2-chlorophenoxy)ethyl]piperazino]-4-keto-butyl]thiophene-3-carboxamide Formula: C21H26ClN3O3S MolecularWeight: 435.96744

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCOC2=CC=CC=C2Cl)C(=O)CCCNC(=O)C3=CSC=C3

Isomeric SMILES

C1CN(CCN1CCOC2=CC=CC=C2Cl)C(=O)CCCNC(=O)C3=CSC=C3

InChI

InChI=1S/C21H26ClN3O3S/c22-18-4-1-2-5-19(18)28-14-13-24-9-11-25(12-10-24)20(26)6-3-8-23-21(27)17-7-15-29-16-17/h1-2,4-5,7,15-16H,3,6,8-14H2,(H,23,27)