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

Systemtic Name: 1-phenyl-3-[4-[3-[(phenylmethyl)amino]-2H-1,3,4-thiadiazol-2-yl]phenyl]thiourea Openeye Name: 1-[4-[3-(benzylamino)-2H-1,3,4-thiadiazol-2-yl]phenyl]-3-phenyl-thiourea CAS Name: 1-phenyl-3-[4-[3-[(phenylmethyl)amino]-2H-1,3,4-thiadiazol-2-yl]phenyl]thiourea IUPAC Name: 1-[4-[3-(benzylamino)-2H-1,3,4-thiadiazol-2-yl]phenyl]-3-phenylthiourea Traditional Name: 1-[4-[3-(benzylamino)-2H-1,3,4-thiadiazol-2-yl]phenyl]-3-phenyl-thiourea Formula: C22H21N5S2 MolecularWeight: 419.56564

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNN2C(SC=N2)C3=CC=C(C=C3)NC(=S)NC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CNN2C(SC=N2)C3=CC=C(C=C3)NC(=S)NC4=CC=CC=C4

InChI

InChI=1S/C22H21N5S2/c28-22(25-19-9-5-2-6-10-19)26-20-13-11-18(12-14-20)21-27(24-16-29-21)23-15-17-7-3-1-4-8-17/h1-14,16,21,23H,15H2,(H2,25,26,28)