N-[4-[[3-chloranyl-4-(1-methylpiperidin-4-yl)oxy-phenyl]carbamothioylamino]phenyl]ethanamide

Systemtic Name: N-[4-[[3-chloranyl-4-(1-methylpiperidin-4-yl)oxy-phenyl]carbamothioylamino]phenyl]ethanamide Openeye Name: N-[4-[[3-chloro-4-[(1-methyl-4-piperidyl)oxy]phenyl]carbamothioylamino]phenyl]acetamide CAS Name: N-[4-[[[3-chloro-4-[(1-methyl-4-piperidinyl)oxy]anilino]-sulfanylidenemethyl]amino]phenyl]acetamide IUPAC Name: N-[4-[[3-chloro-4-(1-methylpiperidin-4-yl)oxyphenyl]carbamothioylamino]phenyl]acetamide Traditional Name: N-[4-[[3-chloro-4-[(1-methyl-4-piperidyl)oxy]phenyl]thiocarbamoylamino]phenyl]acetamide Formula: C21H25ClN4O2S MolecularWeight: 432.9668

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=S)NC2=CC(=C(C=C2)OC3CCN(CC3)C)Cl

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=S)NC2=CC(=C(C=C2)OC3CCN(CC3)C)Cl

InChI

InChI=1S/C21H25ClN4O2S/c1-14(27)23-15-3-5-16(6-4-15)24-21(29)25-17-7-8-20(19(22)13-17)28-18-9-11-26(2)12-10-18/h3-8,13,18H,9-12H2,1-2H3,(H,23,27)(H2,24,25,29)