1-[(2S)-1-[4-(2-ethoxyphenyl)piperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]urea

Systemtic Name: 1-[(2S)-1-[4-(2-ethoxyphenyl)piperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]urea Openeye Name: [(1S)-1-[4-(2-ethoxyphenyl)piperazine-1-carbonyl]-3-methylsulfanyl-propyl]urea CAS Name: [(2S)-1-[4-(2-ethoxyphenyl)-1-piperazinyl]-4-(methylthio)-1-oxobutan-2-yl]urea IUPAC Name: [(2S)-1-[4-(2-ethoxyphenyl)piperazin-1-yl]-4-methylsulfanyl-1-oxobutan-2-yl]urea Traditional Name: [(1S)-3-(methylthio)-1-(4-o-phenetylpiperazine-1-carbonyl)propyl]urea Formula: C18H28N4O3S MolecularWeight: 380.50492

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)C(CCSC)NC(=O)N

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)[C@H](CCSC)NC(=O)N

InChI

InChI=1S/C18H28N4O3S/c1-3-25-16-7-5-4-6-15(16)21-9-11-22(12-10-21)17(23)14(8-13-26-2)20-18(19)24/h4-7,14H,3,8-13H2,1-2H3,(H3,19,20,24)/t14-/m0/s1