1-[(6-ethynyl-1-benzothiophen-2-yl)sulfonyl]-N-methyl-piperazine-2-carboxamide

Systemtic Name: 1-[(6-ethynyl-1-benzothiophen-2-yl)sulfonyl]-N-methyl-piperazine-2-carboxamide Openeye Name: 1-(6-ethynylbenzothiophen-2-yl)sulfonyl-N-methyl-piperazine-2-carboxamide CAS Name: 1-[(6-ethynyl-1-benzothiophen-2-yl)sulfonyl]-N-methyl-2-piperazinecarboxamide IUPAC Name: 1-[(6-ethynyl-1-benzothiophen-2-yl)sulfonyl]-N-methylpiperazine-2-carboxamide Traditional Name: 1-(6-ethynylbenzothiophen-2-yl)sulfonyl-N-methyl-piperazine-2-carboxamide Formula: C16H17N3O3S2 MolecularWeight: 363.45448

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CNCCN1S(=O)(=O)C2=CC3=C(S2)C=C(C=C3)C#C

Isomeric SMILES

CNC(=O)C1CNCCN1S(=O)(=O)C2=CC3=C(S2)C=C(C=C3)C#C

InChI

InChI=1S/C16H17N3O3S2/c1-3-11-4-5-12-9-15(23-14(12)8-11)24(21,22)19-7-6-18-10-13(19)16(20)17-2/h1,4-5,8-9,13,18H,6-7,10H2,2H3,(H,17,20)