1-(3-chloranyl-4-methyl-phenyl)-3-[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]thiourea

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-3-[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]thiourea Openeye Name: 1-(3-chloro-4-methyl-phenyl)-3-(4-indolin-1-ylsulfonylphenyl)thiourea CAS Name: 1-(3-chloro-4-methylphenyl)-3-[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]thiourea IUPAC Name: 1-(3-chloro-4-methylphenyl)-3-[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]thiourea Traditional Name: 1-(3-chloro-4-methyl-phenyl)-3-(4-indolin-1-ylsulfonylphenyl)thiourea Formula: C22H20ClN3O2S2 MolecularWeight: 457.9961

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C43)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C43)Cl

InChI

InChI=1S/C22H20ClN3O2S2/c1-15-6-7-18(14-20(15)23)25-22(29)24-17-8-10-19(11-9-17)30(27,28)26-13-12-16-4-2-3-5-21(16)26/h2-11,14H,12-13H2,1H3,(H2,24,25,29)