N-[6-[4-[3-(4-chloranylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]pyridin-3-yl]thiophene-2-carboxamide

Systemtic Name: N-[6-[4-[3-(4-chloranylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]pyridin-3-yl]thiophene-2-carboxamide Openeye Name: N-[6-[4-[3-(4-chlorophenoxy)-2-hydroxy-propyl]piperazin-1-yl]-3-pyridyl]thiophene-2-carboxamide CAS Name: N-[6-[4-[3-(4-chlorophenoxy)-2-hydroxypropyl]-1-piperazinyl]-3-pyridinyl]-2-thiophenecarboxamide IUPAC Name: N-[6-[4-[3-(4-chlorophenoxy)-2-hydroxypropyl]piperazin-1-yl]pyridin-3-yl]thiophene-2-carboxamide Traditional Name: N-[6-[4-[3-(4-chlorophenoxy)-2-hydroxy-propyl]piperazino]-3-pyridyl]thiophene-2-carboxamide Formula: C23H25ClN4O3S MolecularWeight: 472.9876

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(COC2=CC=C(C=C2)Cl)O)C3=NC=C(C=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1CC(COC2=CC=C(C=C2)Cl)O)C3=NC=C(C=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C23H25ClN4O3S/c24-17-3-6-20(7-4-17)31-16-19(29)15-27-9-11-28(12-10-27)22-8-5-18(14-25-22)26-23(30)21-2-1-13-32-21/h1-8,13-14,19,29H,9-12,15-16H2,(H,26,30)