1-phenazin-2-yl-3-(2,4,4-trimethylpentan-2-yl)thiourea

Systemtic Name: 1-phenazin-2-yl-3-(2,4,4-trimethylpentan-2-yl)thiourea Openeye Name: 1-phenazin-2-yl-3-(1,1,3,3-tetramethylbutyl)thiourea CAS Name: 1-(2-phenazinyl)-3-(2,4,4-trimethylpentan-2-yl)thiourea IUPAC Name: 1-phenazin-2-yl-3-(2,4,4-trimethylpentan-2-yl)thiourea Traditional Name: 1-phenazin-2-yl-3-(1,1,3,3-tetramethylbutyl)thiourea Formula: C21H26N4S MolecularWeight: 366.52294

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)NC(=S)NC1=CC2=NC3=CC=CC=C3N=C2C=C1

Isomeric SMILES

CC(C)(C)CC(C)(C)NC(=S)NC1=CC2=NC3=CC=CC=C3N=C2C=C1

InChI

InChI=1S/C21H26N4S/c1-20(2,3)13-21(4,5)25-19(26)22-14-10-11-17-18(12-14)24-16-9-7-6-8-15(16)23-17/h6-12H,13H2,1-5H3,(H2,22,25,26)