1-[6-(1H-imidazol-5-yl)hexyl]-3-phenyl-thiourea

Systemtic Name: 1-[6-(1H-imidazol-5-yl)hexyl]-3-phenyl-thiourea Openeye Name: 1-[6-(1H-imidazol-5-yl)hexyl]-3-phenyl-thiourea CAS Name: 1-[6-(1H-imidazol-5-yl)hexyl]-3-phenylthiourea IUPAC Name: 1-[6-(1H-imidazol-5-yl)hexyl]-3-phenylthiourea Traditional Name: 1-[6-(1H-imidazol-5-yl)hexyl]-3-phenyl-thiourea Formula: C16H22N4S MolecularWeight: 302.43768

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NCCCCCCC2=CN=CN2

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NCCCCCCC2=CN=CN2

InChI

InChI=1S/C16H22N4S/c21-16(20-14-8-5-3-6-9-14)18-11-7-2-1-4-10-15-12-17-13-19-15/h3,5-6,8-9,12-13H,1-2,4,7,10-11H2,(H,17,19)(H2,18,20,21)