2-[4-(2,5-dimethylthiophen-3-yl)sulfonylpiperazin-1-yl]-1,3-benzoxazole

Systemtic Name: 2-[4-(2,5-dimethylthiophen-3-yl)sulfonylpiperazin-1-yl]-1,3-benzoxazole Openeye Name: 2-[4-[(2,5-dimethyl-3-thienyl)sulfonyl]piperazin-1-yl]-1,3-benzoxazole CAS Name: 2-[4-[(2,5-dimethyl-3-thiophenyl)sulfonyl]-1-piperazinyl]-1,3-benzoxazole IUPAC Name: 2-[4-(2,5-dimethylthiophen-3-yl)sulfonylpiperazin-1-yl]-1,3-benzoxazole Traditional Name: 2-[4-[(2,5-dimethyl-3-thienyl)sulfonyl]piperazino]-1,3-benzoxazole Formula: C17H19N3O3S2 MolecularWeight: 377.48106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)S(=O)(=O)N2CCN(CC2)C3=NC4=CC=CC=C4O3

Isomeric SMILES

CC1=CC(=C(S1)C)S(=O)(=O)N2CCN(CC2)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C17H19N3O3S2/c1-12-11-16(13(2)24-12)25(21,22)20-9-7-19(8-10-20)17-18-14-5-3-4-6-15(14)23-17/h3-6,11H,7-10H2,1-2H3