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

Systemtic Name: 1-[3-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-3-cyclopentyl-thiourea Openeye Name: 1-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-3-cyclopentyl-thiourea CAS Name: 1-[3-[(4-bromo-1-pyrazolyl)methyl]phenyl]-3-cyclopentylthiourea IUPAC Name: 1-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-3-cyclopentylthiourea Traditional Name: 1-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-3-cyclopentyl-thiourea Formula: C16H19BrN4S MolecularWeight: 379.31786

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=S)NC2=CC=CC(=C2)CN3C=C(C=N3)Br

Isomeric SMILES

C1CCC(C1)NC(=S)NC2=CC=CC(=C2)CN3C=C(C=N3)Br

InChI

InChI=1S/C16H19BrN4S/c17-13-9-18-21(11-13)10-12-4-3-7-15(8-12)20-16(22)19-14-5-1-2-6-14/h3-4,7-9,11,14H,1-2,5-6,10H2,(H2,19,20,22)