1-[2-(butylamino)-5-(dimethylsulfamoyl)phenyl]-3-(2-dimethylaminoethyl)thiourea

Systemtic Name: 1-[2-(butylamino)-5-(dimethylsulfamoyl)phenyl]-3-(2-dimethylaminoethyl)thiourea Openeye Name: 1-[2-(butylamino)-5-(dimethylsulfamoyl)phenyl]-3-(2-dimethylaminoethyl)thiourea CAS Name: 1-[2-(butylamino)-5-(dimethylsulfamoyl)phenyl]-3-(2-dimethylaminoethyl)thiourea IUPAC Name: 1-[2-(butylamino)-5-(dimethylsulfamoyl)phenyl]-3-(2-dimethylaminoethyl)thiourea Traditional Name: 1-[2-(butylamino)-5-(dimethylsulfamoyl)phenyl]-3-(2-dimethylaminoethyl)thiourea Formula: C17H31N5O2S2 MolecularWeight: 401.59034

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NC(=S)NCCN(C)C

Isomeric SMILES

CCCCNC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NC(=S)NCCN(C)C

InChI

InChI=1S/C17H31N5O2S2/c1-6-7-10-18-15-9-8-14(26(23,24)22(4)5)13-16(15)20-17(25)19-11-12-21(2)3/h8-9,13,18H,6-7,10-12H2,1-5H3,(H2,19,20,25)