4-[[4-(azepan-1-ylsulfonyl)piperazin-1-yl]methyl]-2-(4-ethoxyphenyl)-1,3-thiazole

Systemtic Name: 4-[[4-(azepan-1-ylsulfonyl)piperazin-1-yl]methyl]-2-(4-ethoxyphenyl)-1,3-thiazole Openeye Name: 4-[[4-(azepan-1-ylsulfonyl)piperazin-1-yl]methyl]-2-(4-ethoxyphenyl)thiazole CAS Name: 4-[[4-(1-azepanylsulfonyl)-1-piperazinyl]methyl]-2-(4-ethoxyphenyl)thiazole IUPAC Name: 4-[[4-(azepan-1-ylsulfonyl)piperazin-1-yl]methyl]-2-(4-ethoxyphenyl)-1,3-thiazole Traditional Name: 4-[[4-(azepan-1-ylsulfonyl)piperazino]methyl]-2-p-phenetyl-thiazole Formula: C22H32N4O3S2 MolecularWeight: 464.64448

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC(=CS2)CN3CCN(CC3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC(=CS2)CN3CCN(CC3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C22H32N4O3S2/c1-2-29-21-9-7-19(8-10-21)22-23-20(18-30-22)17-24-13-15-26(16-14-24)31(27,28)25-11-5-3-4-6-12-25/h7-10,18H,2-6,11-17H2,1H3