1-(3-ethylphenyl)-3-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)thiourea

Systemtic Name: 1-(3-ethylphenyl)-3-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)thiourea Openeye Name: 1-(3-ethylphenyl)-3-(2-morpholino-1,3-benzothiazol-6-yl)thiourea CAS Name: 1-(3-ethylphenyl)-3-[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]thiourea IUPAC Name: 1-(3-ethylphenyl)-3-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)thiourea Traditional Name: 1-(3-ethylphenyl)-3-(2-morpholino-1,3-benzothiazol-6-yl)thiourea Formula: C20H22N4OS2 MolecularWeight: 398.54488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=S)NC2=CC3=C(C=C2)N=C(S3)N4CCOCC4

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=S)NC2=CC3=C(C=C2)N=C(S3)N4CCOCC4

InChI

InChI=1S/C20H22N4OS2/c1-2-14-4-3-5-15(12-14)21-19(26)22-16-6-7-17-18(13-16)27-20(23-17)24-8-10-25-11-9-24/h3-7,12-13H,2,8-11H2,1H3,(H2,21,22,26)