1-(1,2-benzoxazol-3-yl)-3-(3,4,5-trimethoxyphenyl)thiourea

Systemtic Name: 1-(1,2-benzoxazol-3-yl)-3-(3,4,5-trimethoxyphenyl)thiourea Openeye Name: 1-(1,2-benzoxazol-3-yl)-3-(3,4,5-trimethoxyphenyl)thiourea CAS Name: 1-(1,2-benzoxazol-3-yl)-3-(3,4,5-trimethoxyphenyl)thiourea IUPAC Name: 1-(1,2-benzoxazol-3-yl)-3-(3,4,5-trimethoxyphenyl)thiourea Traditional Name: 1-indoxazen-3-yl-3-(3,4,5-trimethoxyphenyl)thiourea Formula: C17H17N3O4S MolecularWeight: 359.39958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=S)NC2=NOC3=CC=CC=C32

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=S)NC2=NOC3=CC=CC=C32

InChI

InChI=1S/C17H17N3O4S/c1-21-13-8-10(9-14(22-2)15(13)23-3)18-17(25)19-16-11-6-4-5-7-12(11)24-20-16/h4-9H,1-3H3,(H2,18,19,20,25)