1-(3-chloranyl-2-methyl-phenyl)-3-[[4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoyl]amino]thiourea

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-3-[[4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoyl]amino]thiourea Openeye Name: 1-(3-chloro-2-methyl-phenyl)-3-[[4-methyl-2-(p-tolylsulfonylamino)pentanoyl]amino]thiourea CAS Name: 1-(3-chloro-2-methylphenyl)-3-[[4-methyl-2-[(4-methylphenyl)sulfonylamino]-1-oxopentyl]amino]thiourea IUPAC Name: 1-(3-chloro-2-methylphenyl)-3-[[4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoyl]amino]thiourea Traditional Name: 1-(3-chloro-2-methyl-phenyl)-3-[[4-methyl-2-(tosylamino)pentanoyl]amino]thiourea Formula: C21H27ClN4O3S2 MolecularWeight: 483.04708

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27ClN4O3S2/c1-13(2)12-19(26-31(28,29)16-10-8-14(3)9-11-16)20(27)24-25-21(30)23-18-7-5-6-17(22)15(18)4/h5-11,13,19,26H,12H2,1-4H3,(H,24,27)(H2,23,25,30)