1-[4-[4-(2-ethylbutanoyl)piperazin-1-yl]phenyl]-3-(4-methylsulfanylphenyl)urea

Systemtic Name: 1-[4-[4-(2-ethylbutanoyl)piperazin-1-yl]phenyl]-3-(4-methylsulfanylphenyl)urea Openeye Name: 1-[4-[4-(2-ethylbutanoyl)piperazin-1-yl]phenyl]-3-(4-methylsulfanylphenyl)urea CAS Name: 1-[4-[4-(2-ethyl-1-oxobutyl)-1-piperazinyl]phenyl]-3-[4-(methylthio)phenyl]urea IUPAC Name: 1-[4-[4-(2-ethylbutanoyl)piperazin-1-yl]phenyl]-3-(4-methylsulfanylphenyl)urea Traditional Name: 1-[4-[4-(2-ethylbutanoyl)piperazino]phenyl]-3-[4-(methylthio)phenyl]urea Formula: C24H32N4O2S MolecularWeight: 440.60148

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)NC3=CC=C(C=C3)SC

Isomeric SMILES

CCC(CC)C(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)NC3=CC=C(C=C3)SC

InChI

InChI=1S/C24H32N4O2S/c1-4-18(5-2)23(29)28-16-14-27(15-17-28)21-10-6-19(7-11-21)25-24(30)26-20-8-12-22(31-3)13-9-20/h6-13,18H,4-5,14-17H2,1-3H3,(H2,25,26,30)