1-(3-chloranyl-2-methyl-phenyl)-3-[(4-methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)carbonylamino]thiourea

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-3-[(4-methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)carbonylamino]thiourea Openeye Name: 1-(3-chloro-2-methyl-phenyl)-3-[(4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzoyl)amino]thiourea CAS Name: 1-(3-chloro-2-methylphenyl)-3-[[[4-methoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-oxomethyl]amino]thiourea IUPAC Name: 1-(3-chloro-2-methylphenyl)-3-[(4-methoxy-3-pyrrolidin-1-ylsulfonylbenzoyl)amino]thiourea Traditional Name: 1-(3-chloro-2-methyl-phenyl)-3-[(4-methoxy-3-pyrrolidinosulfonyl-benzoyl)amino]thiourea Formula: C20H23ClN4O4S2 MolecularWeight: 483.00402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=S)NNC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)NNC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C20H23ClN4O4S2/c1-13-15(21)6-5-7-16(13)22-20(30)24-23-19(26)14-8-9-17(29-2)18(12-14)31(27,28)25-10-3-4-11-25/h5-9,12H,3-4,10-11H2,1-2H3,(H,23,26)(H2,22,24,30)