[4-(4-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)methanone

Systemtic Name: [4-(4-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)methanone Openeye Name: [4-(4-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-[1-(2-thienylsulfonyl)pyrrolidin-2-yl]methanone CAS Name: [4-(4-ethoxy-1,3-benzothiazol-2-yl)-1-piperazinyl]-(1-thiophen-2-ylsulfonyl-2-pyrrolidinyl)methanone IUPAC Name: [4-(4-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)methanone Traditional Name: [4-(4-ethoxy-1,3-benzothiazol-2-yl)piperazino]-[1-(2-thienylsulfonyl)pyrrolidin-2-yl]methanone Formula: C22H26N4O4S3 MolecularWeight: 506.66124

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)C4CCCN4S(=O)(=O)C5=CC=CS5

Isomeric SMILES

CCOC1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)C4CCCN4S(=O)(=O)C5=CC=CS5

InChI

InChI=1S/C22H26N4O4S3/c1-2-30-17-7-3-8-18-20(17)23-22(32-18)25-13-11-24(12-14-25)21(27)16-6-4-10-26(16)33(28,29)19-9-5-15-31-19/h3,5,7-9,15-16H,2,4,6,10-14H2,1H3