1-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3-(2-sulfanylidene-1,3-benzoxazol-3-yl)propan-1-one

Systemtic Name: 1-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3-(2-sulfanylidene-1,3-benzoxazol-3-yl)propan-1-one Openeye Name: 1-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3-(2-thioxo-1,3-benzoxazol-3-yl)propan-1-one CAS Name: 1-[4-(2,5-dimethylphenyl)-1-piperazinyl]-3-(2-sulfanylidene-1,3-benzoxazol-3-yl)-1-propanone IUPAC Name: 1-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3-(2-sulfanylidene-1,3-benzoxazol-3-yl)propan-1-one Traditional Name: 1-[4-(2,5-dimethylphenyl)piperazino]-3-(2-thioxo-1,3-benzoxazol-3-yl)propan-1-one Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)CCN3C4=CC=CC=C4OC3=S

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)CCN3C4=CC=CC=C4OC3=S

InChI

InChI=1S/C22H25N3O2S/c1-16-7-8-17(2)19(15-16)23-11-13-24(14-12-23)21(26)9-10-25-18-5-3-4-6-20(18)27-22(25)28/h3-8,15H,9-14H2,1-2H3