3-[(4-ethylpiperazin-1-yl)methyl]-5-piperidin-1-ylsulfonyl-1,3-benzoxazole-2-thione

Systemtic Name: 3-[(4-ethylpiperazin-1-yl)methyl]-5-piperidin-1-ylsulfonyl-1,3-benzoxazole-2-thione Openeye Name: 3-[(4-ethylpiperazin-1-yl)methyl]-5-(1-piperidylsulfonyl)-1,3-benzoxazole-2-thione CAS Name: 3-[(4-ethyl-1-piperazinyl)methyl]-5-(1-piperidinylsulfonyl)-1,3-benzoxazole-2-thione IUPAC Name: 3-[(4-ethylpiperazin-1-yl)methyl]-5-piperidin-1-ylsulfonyl-1,3-benzoxazole-2-thione Traditional Name: 3-[(4-ethylpiperazino)methyl]-5-piperidinosulfonyl-1,3-benzoxazole-2-thione Formula: C19H28N4O3S2 MolecularWeight: 424.58062

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CN2C3=C(C=CC(=C3)S(=O)(=O)N4CCCCC4)OC2=S

Isomeric SMILES

CCN1CCN(CC1)CN2C3=C(C=CC(=C3)S(=O)(=O)N4CCCCC4)OC2=S

InChI

InChI=1S/C19H28N4O3S2/c1-2-20-10-12-21(13-11-20)15-23-17-14-16(6-7-18(17)26-19(23)27)28(24,25)22-8-4-3-5-9-22/h6-7,14H,2-5,8-13,15H2,1H3