1-[(2S)-1-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]urea

Systemtic Name: 1-[(2S)-1-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]urea Openeye Name: [(1S)-1-[4-[(5-chloro-2-thienyl)sulfonyl]piperazine-1-carbonyl]-3-methylsulfanyl-propyl]urea CAS Name: [(2S)-1-[4-[(5-chloro-2-thiophenyl)sulfonyl]-1-piperazinyl]-4-(methylthio)-1-oxobutan-2-yl]urea IUPAC Name: [(2S)-1-[4-(5-chlorothiophen-2-yl)sulfonylpiperazin-1-yl]-4-methylsulfanyl-1-oxobutan-2-yl]urea Traditional Name: [(1S)-1-[4-[(5-chloro-2-thienyl)sulfonyl]piperazine-1-carbonyl]-3-(methylthio)propyl]urea Formula: C14H21ClN4O4S3 MolecularWeight: 440.98894

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(S2)Cl)NC(=O)N

Isomeric SMILES

CSCC[C@@H](C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(S2)Cl)NC(=O)N

InChI

InChI=1S/C14H21ClN4O4S3/c1-24-9-4-10(17-14(16)21)13(20)18-5-7-19(8-6-18)26(22,23)12-3-2-11(15)25-12/h2-3,10H,4-9H2,1H3,(H3,16,17,21)/t10-/m0/s1