1-(2-chlorophenyl)-3-[[3-(2-propan-2-ylpyrazol-3-yl)iminoisoindol-1-yl]amino]thiourea

Systemtic Name: 1-(2-chlorophenyl)-3-[[3-(2-propan-2-ylpyrazol-3-yl)iminoisoindol-1-yl]amino]thiourea Openeye Name: 1-(2-chlorophenyl)-3-[[3-(2-isopropylpyrazol-3-yl)iminoisoindol-1-yl]amino]thiourea CAS Name: 1-(2-chlorophenyl)-3-[[3-[(2-propan-2-yl-3-pyrazolyl)imino]-1-isoindolyl]amino]thiourea IUPAC Name: 1-(2-chlorophenyl)-3-[[3-(2-propan-2-ylpyrazol-3-yl)iminoisoindol-1-yl]amino]thiourea Traditional Name: 1-(2-chlorophenyl)-3-[[3-(2-isopropylpyrazol-3-yl)iminoisoindol-1-yl]amino]thiourea Formula: C21H20ClN7S MolecularWeight: 437.9484

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=CC=N1)N=C2C3=CC=CC=C3C(=N2)NNC(=S)NC4=CC=CC=C4Cl

Isomeric SMILES

CC(C)N1C(=CC=N1)N=C2C3=CC=CC=C3C(=N2)NNC(=S)NC4=CC=CC=C4Cl

InChI

InChI=1S/C21H20ClN7S/c1-13(2)29-18(11-12-23-29)25-19-14-7-3-4-8-15(14)20(26-19)27-28-21(30)24-17-10-6-5-9-16(17)22/h3-13H,1-2H3,(H2,24,28,30)(H,25,26,27)