1-[3-(1,3-benzothiazol-2-yl)phenyl]-3-[(4-methoxyphenyl)methyl]thiourea

Systemtic Name: 1-[3-(1,3-benzothiazol-2-yl)phenyl]-3-[(4-methoxyphenyl)methyl]thiourea Openeye Name: 1-[3-(1,3-benzothiazol-2-yl)phenyl]-3-[(4-methoxyphenyl)methyl]thiourea CAS Name: 1-[3-(1,3-benzothiazol-2-yl)phenyl]-3-[(4-methoxyphenyl)methyl]thiourea IUPAC Name: 1-[3-(1,3-benzothiazol-2-yl)phenyl]-3-[(4-methoxyphenyl)methyl]thiourea Traditional Name: 1-[3-(1,3-benzothiazol-2-yl)phenyl]-3-p-anisyl-thiourea Formula: C22H19N3OS2 MolecularWeight: 405.53576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=S)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=S)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H19N3OS2/c1-26-18-11-9-15(10-12-18)14-23-22(27)24-17-6-4-5-16(13-17)21-25-19-7-2-3-8-20(19)28-21/h2-13H,14H2,1H3,(H2,23,24,27)