1-[1-[(3-cyanophenyl)methyl]pyrazol-4-yl]-3-(2,3-dihydro-1H-inden-2-yl)thiourea

Systemtic Name: 1-[1-[(3-cyanophenyl)methyl]pyrazol-4-yl]-3-(2,3-dihydro-1H-inden-2-yl)thiourea Openeye Name: 1-[1-[(3-cyanophenyl)methyl]pyrazol-4-yl]-3-indan-2-yl-thiourea CAS Name: 1-[1-[(3-cyanophenyl)methyl]-4-pyrazolyl]-3-(2,3-dihydro-1H-inden-2-yl)thiourea IUPAC Name: 1-[1-[(3-cyanophenyl)methyl]pyrazol-4-yl]-3-(2,3-dihydro-1H-inden-2-yl)thiourea Traditional Name: 1-[1-(3-cyanobenzyl)pyrazol-4-yl]-3-indan-2-yl-thiourea Formula: C21H19N5S MolecularWeight: 373.47406

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC2=CC=CC=C21)NC(=S)NC3=CN(N=C3)CC4=CC=CC(=C4)C#N

Isomeric SMILES

C1C(CC2=CC=CC=C21)NC(=S)NC3=CN(N=C3)CC4=CC=CC(=C4)C#N

InChI

InChI=1S/C21H19N5S/c22-11-15-4-3-5-16(8-15)13-26-14-20(12-23-26)25-21(27)24-19-9-17-6-1-2-7-18(17)10-19/h1-8,12,14,19H,9-10,13H2,(H2,24,25,27)