1-[3-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-3-cyclopropyl-thiourea

Systemtic Name: 1-[3-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-3-cyclopropyl-thiourea Openeye Name: 1-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-3-cyclopropyl-thiourea CAS Name: 1-[3-[(4-bromo-1-pyrazolyl)methyl]phenyl]-3-cyclopropylthiourea IUPAC Name: 1-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-3-cyclopropylthiourea Traditional Name: 1-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-3-cyclopropyl-thiourea Formula: C14H15BrN4S MolecularWeight: 351.2647

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=S)NC2=CC=CC(=C2)CN3C=C(C=N3)Br

Isomeric SMILES

C1CC1NC(=S)NC2=CC=CC(=C2)CN3C=C(C=N3)Br

InChI

InChI=1S/C14H15BrN4S/c15-11-7-16-19(9-11)8-10-2-1-3-13(6-10)18-14(20)17-12-4-5-12/h1-3,6-7,9,12H,4-5,8H2,(H2,17,18,20)