2-[3-[[3-chloranyl-4-(cyclohexylamino)phenyl]sulfanylcarbamoylamino]phenyl]ethanamide

Systemtic Name: 2-[3-[[3-chloranyl-4-(cyclohexylamino)phenyl]sulfanylcarbamoylamino]phenyl]ethanamide Openeye Name: 2-[3-[[3-chloro-4-(cyclohexylamino)phenyl]sulfanylcarbamoylamino]phenyl]acetamide CAS Name: 2-[3-[[[[[3-chloro-4-(cyclohexylamino)phenyl]thio]amino]-oxomethyl]amino]phenyl]acetamide IUPAC Name: 2-[3-[[3-chloro-4-(cyclohexylamino)phenyl]sulfanylcarbamoylamino]phenyl]acetamide Traditional Name: 2-[3-[[[3-chloro-4-(cyclohexylamino)phenyl]thio]carbamoylamino]phenyl]acetamide Formula: C21H25ClN4O2S MolecularWeight: 432.9668

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=C(C=C(C=C2)SNC(=O)NC3=CC=CC(=C3)CC(=O)N)Cl

Isomeric SMILES

C1CCC(CC1)NC2=C(C=C(C=C2)SNC(=O)NC3=CC=CC(=C3)CC(=O)N)Cl

InChI

InChI=1S/C21H25ClN4O2S/c22-18-13-17(9-10-19(18)24-15-6-2-1-3-7-15)29-26-21(28)25-16-8-4-5-14(11-16)12-20(23)27/h4-5,8-11,13,15,24H,1-3,6-7,12H2,(H2,23,27)(H2,25,26,28)