N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]but-2-ynyl]-1,2-benzothiazole-3-carboxamide

Systemtic Name: N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]but-2-ynyl]-1,2-benzothiazole-3-carboxamide Openeye Name: N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]but-2-ynyl]-1,2-benzothiazole-3-carboxamide CAS Name: N-[4-[4-(2-methoxyphenyl)-1-piperazinyl]but-2-ynyl]-1,2-benzothiazole-3-carboxamide IUPAC Name: N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]but-2-ynyl]-1,2-benzothiazole-3-carboxamide Traditional Name: N-[4-[4-(2-methoxyphenyl)piperazino]but-2-ynyl]-1,2-benzothiazole-3-carboxamide Formula: C23H24N4O2S MolecularWeight: 420.52726

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CC#CCNC(=O)C3=NSC4=CC=CC=C43

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CC#CCNC(=O)C3=NSC4=CC=CC=C43

InChI

InChI=1S/C23H24N4O2S/c1-29-20-10-4-3-9-19(20)27-16-14-26(15-17-27)13-7-6-12-24-23(28)22-18-8-2-5-11-21(18)30-25-22/h2-5,8-11H,12-17H2,1H3,(H,24,28)