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

Systemtic Name: N-[6-[4-[3-(2-methylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]pyridin-3-yl]thiophene-2-carboxamide Openeye Name: N-[6-[4-[2-hydroxy-3-(2-methylphenoxy)propyl]piperazin-1-yl]-3-pyridyl]thiophene-2-carboxamide CAS Name: N-[6-[4-[2-hydroxy-3-(2-methylphenoxy)propyl]-1-piperazinyl]-3-pyridinyl]-2-thiophenecarboxamide IUPAC Name: N-[6-[4-[2-hydroxy-3-(2-methylphenoxy)propyl]piperazin-1-yl]pyridin-3-yl]thiophene-2-carboxamide Traditional Name: N-[6-[4-[2-hydroxy-3-(2-methylphenoxy)propyl]piperazino]-3-pyridyl]thiophene-2-carboxamide Formula: C24H28N4O3S MolecularWeight: 452.56912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC(CN2CCN(CC2)C3=NC=C(C=C3)NC(=O)C4=CC=CS4)O

Isomeric SMILES

CC1=CC=CC=C1OCC(CN2CCN(CC2)C3=NC=C(C=C3)NC(=O)C4=CC=CS4)O

InChI

InChI=1S/C24H28N4O3S/c1-18-5-2-3-6-21(18)31-17-20(29)16-27-10-12-28(13-11-27)23-9-8-19(15-25-23)26-24(30)22-7-4-14-32-22/h2-9,14-15,20,29H,10-13,16-17H2,1H3,(H,26,30)