1-(6-methoxy-1,3-benzothiazol-2-yl)-3-(phenylmethyl)thiourea

Systemtic Name: 1-(6-methoxy-1,3-benzothiazol-2-yl)-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-(6-methoxy-1,3-benzothiazol-2-yl)thiourea CAS Name: 1-(6-methoxy-1,3-benzothiazol-2-yl)-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-(6-methoxy-1,3-benzothiazol-2-yl)thiourea Traditional Name: 1-benzyl-3-(6-methoxy-1,3-benzothiazol-2-yl)thiourea Formula: C16H15N3OS2 MolecularWeight: 329.4398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)NC(=S)NCC3=CC=CC=C3

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)NC(=S)NCC3=CC=CC=C3

InChI

InChI=1S/C16H15N3OS2/c1-20-12-7-8-13-14(9-12)22-16(18-13)19-15(21)17-10-11-5-3-2-4-6-11/h2-9H,10H2,1H3,(H2,17,18,19,21)