1-(2-dimethylaminoethyl)-3-[4-[4-(2-dimethylaminoethylcarbamothioylamino)phenyl]sulfonylphenyl]thiourea

Systemtic Name: 1-(2-dimethylaminoethyl)-3-[4-[4-(2-dimethylaminoethylcarbamothioylamino)phenyl]sulfonylphenyl]thiourea Openeye Name: 1-(2-dimethylaminoethyl)-3-[4-[4-(2-dimethylaminoethylcarbamothioylamino)phenyl]sulfonylphenyl]thiourea CAS Name: 1-(2-dimethylaminoethyl)-3-[4-[4-[[(2-dimethylaminoethylamino)-sulfanylidenemethyl]amino]phenyl]sulfonylphenyl]thiourea IUPAC Name: 1-(2-dimethylaminoethyl)-3-[4-[4-(2-dimethylaminoethylcarbamothioylamino)phenyl]sulfonylphenyl]thiourea Traditional Name: 1-(2-dimethylaminoethyl)-3-[4-[4-(2-dimethylaminoethylthiocarbamoylamino)phenyl]sulfonylphenyl]thiourea Formula: C22H32N6O2S3 MolecularWeight: 508.72348

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=S)NC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NCCN(C)C

Isomeric SMILES

CN(C)CCNC(=S)NC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NCCN(C)C

InChI

InChI=1S/C22H32N6O2S3/c1-27(2)15-13-23-21(31)25-17-5-9-19(10-6-17)33(29,30)20-11-7-18(8-12-20)26-22(32)24-14-16-28(3)4/h5-12H,13-16H2,1-4H3,(H2,23,25,31)(H2,24,26,32)