1-[(3-azidophenyl)-phenyl-methyl]-3-(4-cyanophenyl)thiourea

Systemtic Name: 1-[(3-azidophenyl)-phenyl-methyl]-3-(4-cyanophenyl)thiourea Openeye Name: 1-[(3-azidophenyl)-phenyl-methyl]-3-(4-cyanophenyl)thiourea CAS Name: 1-[(3-azidophenyl)-phenylmethyl]-3-(4-cyanophenyl)thiourea IUPAC Name: 1-[(3-azidophenyl)-phenylmethyl]-3-(4-cyanophenyl)thiourea Traditional Name: 1-[(3-azidophenyl)-phenyl-methyl]-3-(4-cyanophenyl)thiourea Formula: C21H16N6S MolecularWeight: 384.45694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC(=CC=C2)N=[N+]=[N-])NC(=S)NC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC(=CC=C2)N=[N+]=[N-])NC(=S)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H16N6S/c22-14-15-9-11-18(12-10-15)24-21(28)25-20(16-5-2-1-3-6-16)17-7-4-8-19(13-17)26-27-23/h1-13,20H,(H2,24,25,28)