1-phenyl-3-[4-[5-[(phenylmethyl)amino]-1,3,4-thiadiazol-2-yl]phenyl]thiourea

Systemtic Name: 1-phenyl-3-[4-[5-[(phenylmethyl)amino]-1,3,4-thiadiazol-2-yl]phenyl]thiourea Openeye Name: 1-[4-[5-(benzylamino)-1,3,4-thiadiazol-2-yl]phenyl]-3-phenyl-thiourea CAS Name: 1-phenyl-3-[4-[5-[(phenylmethyl)amino]-1,3,4-thiadiazol-2-yl]phenyl]thiourea IUPAC Name: 1-[4-[5-(benzylamino)-1,3,4-thiadiazol-2-yl]phenyl]-3-phenylthiourea Traditional Name: 1-[4-[5-(benzylamino)-1,3,4-thiadiazol-2-yl]phenyl]-3-phenyl-thiourea Formula: C22H19N5S2 MolecularWeight: 417.54976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NN=C(S2)C3=CC=C(C=C3)NC(=S)NC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NN=C(S2)C3=CC=C(C=C3)NC(=S)NC4=CC=CC=C4

InChI

InChI=1S/C22H19N5S2/c28-21(24-18-9-5-2-6-10-18)25-19-13-11-17(12-14-19)20-26-27-22(29-20)23-15-16-7-3-1-4-8-16/h1-14H,15H2,(H,23,27)(H2,24,25,28)