1-(4-fluorophenyl)-3-[[2-oxidanylidene-1-(piperidin-1-ylmethyl)indol-3-ylidene]amino]thiourea

Systemtic Name: 1-(4-fluorophenyl)-3-[[2-oxidanylidene-1-(piperidin-1-ylmethyl)indol-3-ylidene]amino]thiourea Openeye Name: 1-(4-fluorophenyl)-3-[[2-oxo-1-(1-piperidylmethyl)indolin-3-ylidene]amino]thiourea CAS Name: 1-(4-fluorophenyl)-3-[[2-oxo-1-(1-piperidinylmethyl)-3-indolylidene]amino]thiourea IUPAC Name: 1-(4-fluorophenyl)-3-[[2-oxo-1-(piperidin-1-ylmethyl)indol-3-ylidene]amino]thiourea Traditional Name: 1-(4-fluorophenyl)-3-[[2-keto-1-(piperidinomethyl)indolin-3-ylidene]amino]thiourea Formula: C21H22FN5OS MolecularWeight: 411.495683

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CN2C3=CC=CC=C3C(=NNC(=S)NC4=CC=C(C=C4)F)C2=O

Isomeric SMILES

C1CCN(CC1)CN2C3=CC=CC=C3C(=NNC(=S)NC4=CC=C(C=C4)F)C2=O

InChI

InChI=1S/C21H22FN5OS/c22-15-8-10-16(11-9-15)23-21(29)25-24-19-17-6-2-3-7-18(17)27(20(19)28)14-26-12-4-1-5-13-26/h2-3,6-11H,1,4-5,12-14H2,(H2,23,25,29)