1-(2-tert-butyl-5-piperidin-1-yl-1,3-benzothiazol-6-yl)-3-(2-dimethylaminoethyl)thiourea

Systemtic Name: 1-(2-tert-butyl-5-piperidin-1-yl-1,3-benzothiazol-6-yl)-3-(2-dimethylaminoethyl)thiourea Openeye Name: 1-[2-tert-butyl-5-(1-piperidyl)-1,3-benzothiazol-6-yl]-3-(2-dimethylaminoethyl)thiourea CAS Name: 1-[2-tert-butyl-5-(1-piperidinyl)-1,3-benzothiazol-6-yl]-3-(2-dimethylaminoethyl)thiourea IUPAC Name: 1-(2-tert-butyl-5-piperidin-1-yl-1,3-benzothiazol-6-yl)-3-(2-dimethylaminoethyl)thiourea Traditional Name: 1-(2-tert-butyl-5-piperidino-1,3-benzothiazol-6-yl)-3-(2-dimethylaminoethyl)thiourea Formula: C21H33N5S2 MolecularWeight: 419.65022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=CC(=C(C=C2S1)NC(=S)NCCN(C)C)N3CCCCC3

Isomeric SMILES

CC(C)(C)C1=NC2=CC(=C(C=C2S1)NC(=S)NCCN(C)C)N3CCCCC3

InChI

InChI=1S/C21H33N5S2/c1-21(2,3)19-23-16-13-17(26-10-7-6-8-11-26)15(14-18(16)28-19)24-20(27)22-9-12-25(4)5/h13-14H,6-12H2,1-5H3,(H2,22,24,27)