1-(3-chloranyl-4-methyl-phenyl)-3-[(1-methyl-5-morpholin-4-ylsulfonyl-2-oxidanylidene-indol-3-ylidene)amino]thiourea

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-3-[(1-methyl-5-morpholin-4-ylsulfonyl-2-oxidanylidene-indol-3-ylidene)amino]thiourea Openeye Name: 1-(3-chloro-4-methyl-phenyl)-3-[(1-methyl-5-morpholinosulfonyl-2-oxo-indolin-3-ylidene)amino]thiourea CAS Name: 1-(3-chloro-4-methylphenyl)-3-[[1-methyl-5-(4-morpholinylsulfonyl)-2-oxo-3-indolylidene]amino]thiourea IUPAC Name: 1-(3-chloro-4-methylphenyl)-3-[(1-methyl-5-morpholin-4-ylsulfonyl-2-oxoindol-3-ylidene)amino]thiourea Traditional Name: 1-(3-chloro-4-methyl-phenyl)-3-[(2-keto-1-methyl-5-morpholinosulfonyl-indolin-3-ylidene)amino]thiourea Formula: C21H22ClN5O4S2 MolecularWeight: 508.01348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NN=C2C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)N(C2=O)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NN=C2C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)N(C2=O)C)Cl

InChI

InChI=1S/C21H22ClN5O4S2/c1-13-3-4-14(11-17(13)22)23-21(32)25-24-19-16-12-15(5-6-18(16)26(2)20(19)28)33(29,30)27-7-9-31-10-8-27/h3-6,11-12H,7-10H2,1-2H3,(H2,23,25,32)