1-[4-[(1,3-benzothiazol-2-ylamino)sulfamoyl]phenyl]-3-cyclohexyl-thiourea

Systemtic Name: 1-[4-[(1,3-benzothiazol-2-ylamino)sulfamoyl]phenyl]-3-cyclohexyl-thiourea Openeye Name: 1-[4-[(1,3-benzothiazol-2-ylamino)sulfamoyl]phenyl]-3-cyclohexyl-thiourea CAS Name: 1-[4-[(1,3-benzothiazol-2-ylamino)sulfamoyl]phenyl]-3-cyclohexylthiourea IUPAC Name: 1-[4-[(1,3-benzothiazol-2-ylamino)sulfamoyl]phenyl]-3-cyclohexylthiourea Traditional Name: 1-[4-[(1,3-benzothiazol-2-ylamino)sulfamoyl]phenyl]-3-cyclohexyl-thiourea Formula: C20H23N5O2S3 MolecularWeight: 461.62392

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NNC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CCC(CC1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NNC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H23N5O2S3/c26-30(27,25-24-20-23-17-8-4-5-9-18(17)29-20)16-12-10-15(11-13-16)22-19(28)21-14-6-2-1-3-7-14/h4-5,8-14,25H,1-3,6-7H2,(H,23,24)(H2,21,22,28)